1-Methylnaphthalene
Simulation outputs:
Parameter | Value | |
Field strength | 499.84(MHz) | |
RMSD of the fit | 0.01713 | |
Temperature | 298 K | |
pH | 7.4 | |
InChI | InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3 | |
Note 1 | hsqc connectivities |
Sample description:
Compound | Type | Concentration |
---|---|---|
1-methylnaphthalene | Solute | Saturated1 |
CDCl3 | Solvent | 100% |
TMS | Reference | 0.5% |
Spin System Matrix
12 | 13 | 14 | 18 | 17 | 20 | 19 | 15 | 16 | 21 | |
---|---|---|---|---|---|---|---|---|---|---|
12 | 2.692 | -14.0 | -14.9 | 0 | 0 | 0 | 0 | 0 | 0 | 0 |
13 | 0 | 2.692 | -14.9 | 0 | 0 | 0 | 0 | 0 | 0 | 0 |
14 | 0 | 0 | 2.692 | 0 | 0 | 0 | 0 | 0 | 0 | 0 |
18 | 0 | 0 | 0 | 7.312 | 7.7 | 1.342 | 0 | 0 | 0 | 0 |
17 | 0 | 0 | 0 | 0 | 7.365 | 7.7 | 0 | 0 | 0 | 0 |
20 | 0 | 0 | 0 | 0 | 0 | 7.7 | 0 | 0 | 0 | 0 |
19 | 0 | 0 | 0 | 0 | 0 | 0 | 7.992 | 8.389 | 1.241 | 0 |
15 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7.512 | 7.05 | 1.241 |
16 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7.477 | 8.389 |
21 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7.839 |
Spectra
Select field strength to view simulated spectra and peak lists (standard and GSD): Autoscale
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PPM | Amplitude | Peak Type |
---|---|---|
2.69201 | 1.0 | standard |
7.30187 | 0.0823499 | standard |
7.30405 | 0.08615 | standard |
7.31726 | 0.14899 | standard |
7.31927 | 0.146124 | standard |
7.3508 | 0.109385 | standard |
7.36596 | 0.165709 | standard |
7.38133 | 0.0694532 | standard |
7.46117 | 0.0426346 | standard |
7.47506 | 0.104358 | standard |
7.48906 | 0.0946961 | standard |
7.49186 | 0.0954166 | standard |
7.49663 | 0.0905241 | standard |
7.49959 | 0.0900766 | standard |
7.51344 | 0.105697 | standard |
7.52733 | 0.046182 | standard |
7.52913 | 0.042743 | standard |
7.6913 | 0.11897 | standard |
7.6935 | 0.119378 | standard |
7.70645 | 0.109879 | standard |
7.70865 | 0.109249 | standard |
7.82984 | 0.117764 | standard |
7.83216 | 0.117678 | standard |
7.846 | 0.108419 | standard |
7.84833 | 0.108023 | standard |
7.98287 | 0.11596 | standard |
7.9852 | 0.114995 | standard |
7.99914 | 0.108369 | standard |
8.00136 | 0.109392 | standard |
2.69201 | 1.0 | standard |
7.26617 | 0.257038 | standard |
7.36974 | 0.356451 | standard |
7.39666 | 0.369896 | standard |
7.5146 | 0.209971 | standard |
7.59736 | 0.402356 | standard |
7.68063 | 0.183293 | standard |
7.74487 | 0.264268 | standard |
7.84047 | 0.169975 | standard |
7.89462 | 0.205302 | standard |
7.96069 | 0.104769 | standard |
7.99575 | 0.111349 | standard |
8.13446 | 0.060235 | standard |
2.69201 | 1.0 | standard |
7.2941 | 0.285124 | standard |
7.35503 | 0.254331 | standard |
7.38914 | 0.310479 | standard |
7.44441 | 0.131244 | standard |
7.47249 | 0.15023 | standard |
7.49868 | 0.174855 | standard |
7.51599 | 0.17769 | standard |
7.56427 | 0.259303 | standard |
7.63534 | 0.189481 | standard |
7.69494 | 0.131273 | standard |
7.72947 | 0.125366 | standard |
7.77321 | 0.179111 | standard |
7.82495 | 0.100183 | standard |
7.83938 | 0.101638 | standard |
7.86403 | 0.0990201 | standard |
7.92472 | 0.173786 | standard |
8.00175 | 0.084652 | standard |
8.03686 | 0.060258 | standard |
8.08217 | 0.0707171 | standard |
-0.887973 | 1.3125e-05 | standard |
2.69201 | 1.0 | standard |
7.25367 | 0.040634 | standard |
7.30656 | 0.301674 | standard |
7.34607 | 0.216718 | standard |
7.38013 | 0.223941 | standard |
7.42745 | 0.154874 | standard |
7.4566 | 0.124863 | standard |
7.4815 | 0.176397 | standard |
7.52136 | 0.143674 | standard |
7.5468 | 0.20575 | standard |
7.60208 | 0.0687581 | standard |
7.64997 | 0.135902 | standard |
7.68875 | 0.108909 | standard |
7.72482 | 0.100545 | standard |
7.76663 | 0.110513 | standard |
7.78561 | 0.14631 | standard |
7.82019 | 0.0840545 | standard |
7.84456 | 0.084683 | standard |
7.8738 | 0.070955 | standard |
7.90713 | 0.097657 | standard |
7.93772 | 0.134558 | standard |
7.96606 | 0.079468 | standard |
7.99787 | 0.0863401 | standard |
8.02736 | 0.059319 | standard |
8.05759 | 0.076613 | standard |
2.69201 | 1.0 | standard |
7.26033 | 0.041386 | standard |
7.3105 | 0.307644 | standard |
7.34313 | 0.207236 | standard |
7.37838 | 0.213654 | standard |
7.43629 | 0.15093 | standard |
7.46026 | 0.145372 | standard |
7.49059 | 0.166296 | standard |
7.54035 | 0.192979 | standard |
7.59816 | 0.060526 | standard |
7.65503 | 0.127788 | standard |
7.68742 | 0.107099 | standard |
7.72363 | 0.093927 | standard |
7.75667 | 0.100373 | standard |
7.7914 | 0.132429 | standard |
7.81991 | 0.0787012 | standard |
7.84439 | 0.0861057 | standard |
7.86998 | 0.0634595 | standard |
7.89924 | 0.089899 | standard |
7.94316 | 0.123724 | standard |
7.96746 | 0.0763841 | standard |
7.99664 | 0.0860962 | standard |
8.02398 | 0.059734 | standard |
8.04971 | 0.0787574 | standard |
2.69201 | 1.0 | standard |
7.26581 | 0.0422481 | standard |
7.31361 | 0.311303 | standard |
7.34057 | 0.202193 | standard |
7.37654 | 0.196508 | standard |
7.44521 | 0.160996 | standard |
7.49076 | 0.170239 | standard |
7.53422 | 0.182641 | standard |
7.58836 | 0.047602 | standard |
7.60947 | 0.036392 | standard |
7.65915 | 0.123678 | standard |
7.68666 | 0.106707 | standard |
7.72193 | 0.0901122 | standard |
7.74959 | 0.0892577 | standard |
7.79578 | 0.128315 | standard |
7.82033 | 0.075903 | standard |
7.8435 | 0.0873194 | standard |
7.86709 | 0.0610693 | standard |
7.89215 | 0.08539 | standard |
7.91759 | 0.0443952 | standard |
7.94779 | 0.119241 | standard |
7.96897 | 0.0745407 | standard |
7.99577 | 0.0839815 | standard |
8.02122 | 0.0602202 | standard |
8.04354 | 0.0805686 | standard |
2.69201 | 1.0 | standard |
7.28223 | 0.0395552 | standard |
7.29058 | 0.0558591 | standard |
7.32 | 0.18506 | standard |
7.33085 | 0.242238 | standard |
7.36934 | 0.158175 | standard |
7.40762 | 0.056893 | standard |
7.42806 | 0.025152 | standard |
7.43606 | 0.0321406 | standard |
7.46295 | 0.0946826 | standard |
7.47471 | 0.132692 | standard |
7.49339 | 0.193703 | standard |
7.51103 | 0.14761 | standard |
7.52441 | 0.110726 | standard |
7.55057 | 0.0381784 | standard |
7.6358 | 0.00668225 | standard |
7.67876 | 0.116384 | standard |
7.68766 | 0.112819 | standard |
7.71422 | 0.0966976 | standard |
7.72301 | 0.0939095 | standard |
7.77615 | 0.00692325 | standard |
7.81629 | 0.11113 | standard |
7.8253 | 0.0806 | standard |
7.84851 | 0.062176 | standard |
7.85468 | 0.0692955 | standard |
7.86393 | 0.088344 | standard |
7.90341 | 0.00525113 | standard |
7.92974 | 0.006014 | standard |
7.96912 | 0.107047 | standard |
7.97752 | 0.0797211 | standard |
8.002 | 0.0625675 | standard |
8.00812 | 0.0712853 | standard |
8.01669 | 0.0911423 | standard |
2.69201 | 1.0 | standard |
7.29382 | 0.0599602 | standard |
7.29833 | 0.0689311 | standard |
7.31922 | 0.163824 | standard |
7.32368 | 0.159809 | standard |
7.34244 | 0.129034 | standard |
7.36736 | 0.161109 | standard |
7.39272 | 0.0618845 | standard |
7.45024 | 0.035179 | standard |
7.46912 | 0.0923501 | standard |
7.47375 | 0.0938147 | standard |
7.49399 | 0.17218 | standard |
7.51412 | 0.0987577 | standard |
7.51901 | 0.099131 | standard |
7.53766 | 0.0405341 | standard |
7.54185 | 0.0331021 | standard |
7.68575 | 0.117976 | standard |
7.69021 | 0.117442 | standard |
7.71028 | 0.104154 | standard |
7.71489 | 0.102284 | standard |
7.80625 | 0.00951 | standard |
7.82372 | 0.11075 | standard |
7.82929 | 0.0974783 | standard |
7.84961 | 0.0878121 | standard |
7.85516 | 0.0966593 | standard |
7.95925 | 0.00899138 | standard |
7.9767 | 0.109727 | standard |
7.98197 | 0.0971737 | standard |
8.00265 | 0.0885711 | standard |
8.00816 | 0.098314 | standard |
-0.897892 | 1.125e-06 | standard |
2.69201 | 1.0 | standard |
7.299 | 0.0736207 | standard |
7.30196 | 0.0791532 | standard |
7.31806 | 0.153105 | standard |
7.32105 | 0.148862 | standard |
7.34752 | 0.116022 | standard |
7.36648 | 0.164551 | standard |
7.38559 | 0.0663274 | standard |
7.45455 | 0.0349581 | standard |
7.45714 | 0.0389634 | standard |
7.47226 | 0.0949058 | standard |
7.47462 | 0.0967133 | standard |
7.49344 | 0.151197 | standard |
7.4948 | 0.15157 | standard |
7.51386 | 0.100168 | standard |
7.51636 | 0.0995737 | standard |
7.53117 | 0.0433917 | standard |
7.53398 | 0.0383581 | standard |
7.68929 | 0.119679 | standard |
7.69213 | 0.119822 | standard |
7.70798 | 0.107074 | standard |
7.71098 | 0.106501 | standard |
7.80789 | 0.00444513 | standard |
7.82753 | 0.114483 | standard |
7.83098 | 0.110359 | standard |
7.84736 | 0.101807 | standard |
7.85093 | 0.102876 | standard |
7.96094 | 0.00435025 | standard |
7.9806 | 0.113813 | standard |
7.98389 | 0.109663 | standard |
8.00056 | 0.101723 | standard |
8.00385 | 0.104966 | standard |
8.02352 | 0.00393125 | standard |
2.69201 | 1.0 | standard |
7.30187 | 0.0823461 | standard |
7.30405 | 0.0861457 | standard |
7.31726 | 0.14896 | standard |
7.31927 | 0.146093 | standard |
7.3508 | 0.109375 | standard |
7.36596 | 0.165708 | standard |
7.38133 | 0.0694552 | standard |
7.46117 | 0.0426315 | standard |
7.47506 | 0.104346 | standard |
7.48906 | 0.094669 | standard |
7.49186 | 0.0953888 | standard |
7.49663 | 0.090498 | standard |
7.49959 | 0.0900518 | standard |
7.51344 | 0.105683 | standard |
7.52733 | 0.046178 | standard |
7.52914 | 0.042737 | standard |
7.6913 | 0.118952 | standard |
7.6935 | 0.11936 | standard |
7.70645 | 0.109864 | standard |
7.70865 | 0.109235 | standard |
7.82984 | 0.117746 | standard |
7.83216 | 0.11766 | standard |
7.846 | 0.108405 | standard |
7.84833 | 0.108009 | standard |
7.98287 | 0.115944 | standard |
7.9852 | 0.114978 | standard |
7.99914 | 0.108354 | standard |
8.00136 | 0.109378 | standard |
2.69201 | 1.0 | standard |
7.30381 | 0.0890713 | standard |
7.30545 | 0.0918191 | standard |
7.31651 | 0.143841 | standard |
7.31816 | 0.141588 | standard |
7.35298 | 0.105132 | standard |
7.3657 | 0.167118 | standard |
7.37845 | 0.0718552 | standard |
7.46386 | 0.045016 | standard |
7.47566 | 0.108408 | standard |
7.48745 | 0.0874032 | standard |
7.48928 | 0.0843031 | standard |
7.49936 | 0.0801982 | standard |
7.50118 | 0.0837182 | standard |
7.51299 | 0.108694 | standard |
7.52476 | 0.0485211 | standard |
7.69277 | 0.120087 | standard |
7.69442 | 0.120568 | standard |
7.70543 | 0.112392 | standard |
7.70708 | 0.111775 | standard |
7.83143 | 0.120229 | standard |
7.83307 | 0.12065 | standard |
7.845 | 0.112481 | standard |
7.84663 | 0.111818 | standard |
7.98447 | 0.1187 | standard |
7.9861 | 0.118554 | standard |
7.99801 | 0.110585 | standard |
7.99983 | 0.110507 | standard |
2.69201 | 1.0 | standard |
7.30506 | 0.0939741 | standard |
7.30635 | 0.0960751 | standard |
7.316 | 0.141446 | standard |
7.31729 | 0.139697 | standard |
7.35466 | 0.102218 | standard |
7.36561 | 0.167565 | standard |
7.37657 | 0.0736501 | standard |
7.46575 | 0.047394 | standard |
7.47594 | 0.111132 | standard |
7.48627 | 0.0840909 | standard |
7.48755 | 0.0816347 | standard |
7.50119 | 0.0780064 | standard |
7.50246 | 0.0807333 | standard |
7.5128 | 0.11265 | standard |
7.52284 | 0.0496304 | standard |
7.52408 | 0.0474274 | standard |
7.69369 | 0.118486 | standard |
7.69518 | 0.119073 | standard |
7.70458 | 0.11207 | standard |
7.70606 | 0.111378 | standard |
7.83253 | 0.122251 | standard |
7.83371 | 0.122775 | standard |
7.84425 | 0.115499 | standard |
7.84544 | 0.114841 | standard |
7.98553 | 0.1197 | standard |
7.98682 | 0.119577 | standard |
7.99725 | 0.11322 | standard |
7.99865 | 0.112925 | standard |
2.69201 | 1.0 | standard |
7.30551 | 0.0948213 | standard |
7.30678 | 0.0968567 | standard |
7.31567 | 0.138889 | standard |
7.31694 | 0.137203 | standard |
7.35526 | 0.101064 | standard |
7.36551 | 0.167694 | standard |
7.37578 | 0.074399 | standard |
7.46559 | 0.0463222 | standard |
7.46657 | 0.0479566 | standard |
7.47612 | 0.112248 | standard |
7.48564 | 0.0816172 | standard |
7.48691 | 0.0792291 | standard |
7.50182 | 0.07585 | standard |
7.50309 | 0.0784796 | standard |
7.51267 | 0.11326 | standard |
7.52216 | 0.0508403 | standard |
7.69425 | 0.122593 | standard |
7.69532 | 0.123079 | standard |
7.70429 | 0.113692 | standard |
7.70556 | 0.113049 | standard |
7.83288 | 0.121097 | standard |
7.83405 | 0.121601 | standard |
7.84392 | 0.114834 | standard |
7.84509 | 0.11421 | standard |
7.98605 | 0.121328 | standard |
7.98712 | 0.121613 | standard |
7.99697 | 0.115012 | standard |
7.99814 | 0.114745 | standard |
2.69201 | 1.0 | standard |
7.30587 | 0.0957146 | standard |
7.3071 | 0.0976492 | standard |
7.31544 | 0.136889 | standard |
7.31667 | 0.1353 | standard |
7.35585 | 0.100059 | standard |
7.36547 | 0.1681 | standard |
7.37508 | 0.075076 | standard |
7.46629 | 0.0469743 | standard |
7.46728 | 0.0485709 | standard |
7.47614 | 0.113393 | standard |
7.48527 | 0.0813538 | standard |
7.48627 | 0.0794132 | standard |
7.50238 | 0.0742687 | standard |
7.5036 | 0.0767515 | standard |
7.51258 | 0.112891 | standard |
7.52159 | 0.052403 | standard |
7.69446 | 0.119028 | standard |
7.69569 | 0.119617 | standard |
7.70411 | 0.116091 | standard |
7.70514 | 0.115535 | standard |
7.83325 | 0.120395 | standard |
7.83438 | 0.120918 | standard |
7.84359 | 0.114581 | standard |
7.84472 | 0.113952 | standard |
7.98645 | 0.122413 | standard |
7.98735 | 0.122575 | standard |
7.99671 | 0.116241 | standard |
7.99774 | 0.115872 | standard |
2.69201 | 1.0 | standard |
7.30669 | 0.100803 | standard |
7.30757 | 0.102197 | standard |
7.31517 | 0.138096 | standard |
7.31605 | 0.136929 | standard |
7.35685 | 0.0983885 | standard |
7.36537 | 0.168319 | standard |
7.3739 | 0.076242 | standard |
7.46754 | 0.0485212 | standard |
7.46839 | 0.049947 | standard |
7.47637 | 0.113249 | standard |
7.48445 | 0.0790557 | standard |
7.48532 | 0.0773319 | standard |
7.50351 | 0.0756675 | standard |
7.50438 | 0.0774899 | standard |
7.51246 | 0.11375 | standard |
7.52044 | 0.0513101 | standard |
7.52128 | 0.0497888 | standard |
7.69518 | 0.122001 | standard |
7.69607 | 0.122505 | standard |
7.70353 | 0.11376 | standard |
7.70463 | 0.113037 | standard |
7.83398 | 0.12377 | standard |
7.83474 | 0.124089 | standard |
7.84307 | 0.114939 | standard |
7.84406 | 0.114384 | standard |
7.98699 | 0.118782 | standard |
7.98787 | 0.119222 | standard |
7.99619 | 0.119218 | standard |
7.99707 | 0.118778 | standard |
2.69201 | 1.0 | standard |
7.30699 | 0.102474 | standard |
7.30777 | 0.103731 | standard |
7.31492 | 0.134136 | standard |
7.31592 | 0.132772 | standard |
7.35724 | 0.0976934 | standard |
7.36537 | 0.168396 | standard |
7.3734 | 0.0767841 | standard |
7.46805 | 0.0494491 | standard |
7.46878 | 0.0507343 | standard |
7.47637 | 0.114305 | standard |
7.48405 | 0.0784137 | standard |
7.48482 | 0.0768906 | standard |
7.50382 | 0.0729782 | standard |
7.50482 | 0.0749641 | standard |
7.51242 | 0.113562 | standard |
7.5201 | 0.0535181 | standard |
7.69531 | 0.11903 | standard |
7.69632 | 0.119636 | standard |
7.70349 | 0.117643 | standard |
7.70427 | 0.11713 | standard |
7.83428 | 0.124571 | standard |
7.83493 | 0.124873 | standard |
7.84287 | 0.115658 | standard |
7.84376 | 0.115153 | standard |
7.98728 | 0.119578 | standard |
7.98807 | 0.119997 | standard |
7.99599 | 0.119994 | standard |
7.99678 | 0.119575 | standard |
2.69201 | 1.0 | standard |
7.30712 | 0.100941 | standard |
7.30802 | 0.102376 | standard |
7.31482 | 0.13418 | standard |
7.31572 | 0.132951 | standard |
7.35764 | 0.0971105 | standard |
7.36531 | 0.168115 | standard |
7.373 | 0.077179 | standard |
7.46918 | 0.0516577 | standard |
7.47642 | 0.114336 | standard |
7.48376 | 0.0781455 | standard |
7.48439 | 0.0768592 | standard |
7.50422 | 0.0727775 | standard |
7.50511 | 0.0745483 | standard |
7.51234 | 0.11418 | standard |
7.51965 | 0.0528884 | standard |
7.69569 | 0.123774 | standard |
7.69636 | 0.124199 | standard |
7.70323 | 0.1153 | standard |
7.70414 | 0.114672 | standard |
7.83445 | 0.123604 | standard |
7.83512 | 0.124053 | standard |
7.84275 | 0.118753 | standard |
7.84342 | 0.118259 | standard |
7.98742 | 0.116926 | standard |
7.98833 | 0.117439 | standard |
7.99574 | 0.117436 | standard |
7.99664 | 0.116923 | standard |
2.69201 | 1.0 | standard |
7.30757 | 0.101537 | standard |
7.30844 | 0.10289 | standard |
7.31464 | 0.136056 | standard |
7.31529 | 0.135098 | standard |
7.35833 | 0.0961306 | standard |
7.36527 | 0.168669 | standard |
7.37231 | 0.0779139 | standard |
7.46983 | 0.0540045 | standard |
7.47653 | 0.114283 | standard |
7.48314 | 0.0761549 | standard |
7.48377 | 0.0748895 | standard |
7.50505 | 0.0735304 | standard |
7.50569 | 0.0748543 | standard |
7.5123 | 0.114612 | standard |
7.51893 | 0.0533203 | standard |
7.51956 | 0.0521715 | standard |
7.69604 | 0.122687 | standard |
7.6967 | 0.12317 | standard |
7.70295 | 0.118423 | standard |
7.70361 | 0.117907 | standard |
7.8348 | 0.122424 | standard |
7.83546 | 0.122891 | standard |
7.84241 | 0.118097 | standard |
7.84307 | 0.117592 | standard |
7.98795 | 0.11996 | standard |
7.9886 | 0.120375 | standard |
7.99546 | 0.120372 | standard |
7.99611 | 0.119958 | standard |
2.69201 | 1.0 | standard |
7.30824 | 0.103816 | standard |
7.30897 | 0.105033 | standard |
7.31422 | 0.134719 | standard |
7.31473 | 0.133846 | standard |
7.35932 | 0.0960775 | standard |
7.36527 | 0.168755 | standard |
7.37112 | 0.0778541 | standard |
7.47054 | 0.0539221 | standard |
7.471 | 0.0548316 | standard |
7.47663 | 0.115743 | standard |
7.48233 | 0.0730012 | standard |
7.4828 | 0.0720091 | standard |
7.50612 | 0.0720654 | standard |
7.5066 | 0.0730951 | standard |
7.51219 | 0.115818 | standard |
7.51783 | 0.0548135 | standard |
7.51829 | 0.0538908 | standard |
7.6966 | 0.121258 | standard |
7.69712 | 0.121761 | standard |
7.70238 | 0.116928 | standard |
7.70311 | 0.116218 | standard |
7.83546 | 0.12083 | standard |
7.83598 | 0.121206 | standard |
7.8419 | 0.121207 | standard |
7.84241 | 0.12083 | standard |
7.98868 | 0.123843 | standard |
7.98901 | 0.123938 | standard |
7.99494 | 0.121255 | standard |
7.99546 | 0.120866 | standard |