9-Hydroxyfluorene
Simulation outputs:
|
Parameter | Value |
| Field strength | 400.13(MHz) | |
| RMSD of the fit | 0.02791 | |
| Temperature | 298 K | |
| pH | 7.4 | |
| InChI | InChI=1S/C13H10O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13-14H | |
| Note 1 | 21,22?19,20 | |
| Note 2 | 17,18?15,16 | |
| Note 3 | CDCl3 - 7.25 | |
| Note 4 | Contaminant 1.8 |
Sample description:
| Compound | Type | Concentration |
|---|---|---|
| 9-hydroxyfluorene | Solute | Saturated1 |
| CDCl3 | Solvent | 100% |
| TMS | Reference | 0.5% |
Spin System Matrix
| 15 | 17 | 19 | 21 | 23 | 18 | 16 | 20 | 22 | |
|---|---|---|---|---|---|---|---|---|---|
| 15 | 7.316 | 7.551 | 1.898 | 6.006 | 0 | 0 | 0 | 0 | 0 |
| 17 | 0 | 7.385 | 6.006 | 1.898 | 0 | 0 | 0 | 0 | 0 |
| 19 | 0 | 0 | 7.643 | 0 | 0 | 0 | 0 | 0 | 0 |
| 21 | 0 | 0 | 0 | 7.629 | 0 | 0 | 0 | 0 | 0 |
| 23 | 0 | 0 | 0 | 0 | 5.562 | 0 | 0 | 0 | 0 |
| 18 | 0 | 0 | 0 | 0 | 0 | 7.317 | 7.551 | 1.898 | 6.006 |
| 16 | 0 | 0 | 0 | 0 | 0 | 0 | 7.385 | 6.006 | 1.898 |
| 20 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7.646 | 0 |
| 22 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7.627 |
Spectra
Select field strength to view simulated spectra and peak lists (standard and GSD): Autoscale
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| PPM | Amplitude | Peak Type |
|---|---|---|
| -0.787894 | 1.125e-06 | standard |
| 5.56236 | 0.80743 | standard |
| 7.29654 | 0.190287 | standard |
| 7.30096 | 0.205113 | standard |
| 7.31546 | 0.498581 | standard |
| 7.31934 | 0.380545 | standard |
| 7.33005 | 0.366968 | standard |
| 7.33446 | 0.354565 | standard |
| 7.36674 | 0.313214 | standard |
| 7.37128 | 0.342117 | standard |
| 7.38193 | 0.400022 | standard |
| 7.38582 | 0.517039 | standard |
| 7.40032 | 0.227199 | standard |
| 7.40486 | 0.209366 | standard |
| 7.61766 | 0.554385 | standard |
| 7.62214 | 0.565597 | standard |
| 7.63647 | 1.00003 | standard |
| 7.65088 | 0.523991 | standard |
| 7.65537 | 0.49645 | standard |
| -0.984978 | 4.3125e-05 | standard |
| 5.56236 | 0.539611 | standard |
| 7.23268 | 0.322064 | standard |
| 7.33052 | 0.64062 | standard |
| 7.4304 | 0.965963 | standard |
| 7.55556 | 1.0 | standard |
| 7.63521 | 0.685484 | standard |
| 7.7393 | 0.286682 | standard |
| -0.983291 | 2.7125e-05 | standard |
| 5.56236 | 0.7578 | standard |
| 7.1897 | 0.081404 | standard |
| 7.27635 | 0.549471 | standard |
| 7.34151 | 0.933265 | standard |
| 7.39607 | 0.929811 | standard |
| 7.41389 | 0.890946 | standard |
| 7.49678 | 0.295618 | standard |
| 7.58757 | 0.98307 | standard |
| 7.63132 | 1.0 | standard |
| 7.69662 | 0.5056 | standard |
| -0.994797 | 1.7125e-05 | standard |
| 5.56236 | 0.827421 | standard |
| 7.1968 | 0.0673754 | standard |
| 7.22433 | 0.104511 | standard |
| 7.31754 | 0.645163 | standard |
| 7.3456 | 0.995804 | standard |
| 7.37912 | 0.96649 | standard |
| 7.40548 | 0.772768 | standard |
| 7.46709 | 0.205422 | standard |
| 7.5005 | 0.152455 | standard |
| 7.58579 | 0.869155 | standard |
| 7.60297 | 0.983387 | standard |
| 7.63216 | 1.0 | standard |
| 7.66831 | 0.694386 | standard |
| -0.961867 | 1.3125e-05 | standard |
| 5.56236 | 0.825014 | standard |
| 7.21143 | 0.073954 | standard |
| 7.23561 | 0.110746 | standard |
| 7.29505 | 0.497423 | standard |
| 7.31689 | 0.701818 | standard |
| 7.34665 | 0.971689 | standard |
| 7.37561 | 1.0 | standard |
| 7.40226 | 0.712303 | standard |
| 7.45788 | 0.194293 | standard |
| 7.48632 | 0.127582 | standard |
| 7.58937 | 0.81056 | standard |
| 7.60855 | 0.992564 | standard |
| 7.6355 | 0.967013 | standard |
| 7.66851 | 0.739974 | standard |
| 7.69077 | 0.477972 | standard |
| -0.939253 | 1.0125e-05 | standard |
| 5.56236 | 0.795307 | standard |
| 7.22311 | 0.0764822 | standard |
| 7.24454 | 0.112715 | standard |
| 7.29799 | 0.466831 | standard |
| 7.31984 | 0.709669 | standard |
| 7.34744 | 0.903569 | standard |
| 7.37337 | 0.935389 | standard |
| 7.39975 | 0.645303 | standard |
| 7.45042 | 0.179492 | standard |
| 7.47503 | 0.119996 | standard |
| 7.59243 | 0.741996 | standard |
| 7.61298 | 1.0 | standard |
| 7.63641 | 0.921996 | standard |
| 7.66597 | 0.761221 | standard |
| 7.68657 | 0.462861 | standard |
| -0.99807 | 3.125e-06 | standard |
| 5.56236 | 0.780302 | standard |
| 7.27357 | 0.131553 | standard |
| 7.28314 | 0.156451 | standard |
| 7.31128 | 0.46068 | standard |
| 7.32043 | 0.392799 | standard |
| 7.33933 | 0.487291 | standard |
| 7.34965 | 0.71281 | standard |
| 7.36074 | 0.459458 | standard |
| 7.37948 | 0.422336 | standard |
| 7.38914 | 0.51261 | standard |
| 7.41687 | 0.187005 | standard |
| 7.42702 | 0.158769 | standard |
| 7.60861 | 0.584455 | standard |
| 7.62038 | 0.708285 | standard |
| 7.62675 | 0.790178 | standard |
| 7.63687 | 1.00002 | standard |
| 7.64731 | 0.651985 | standard |
| 7.65484 | 0.598228 | standard |
| 7.66563 | 0.465761 | standard |
| -0.387876 | 1.125e-06 | standard |
| 5.56236 | 0.782419 | standard |
| 7.2891 | 0.164526 | standard |
| 7.29521 | 0.183963 | standard |
| 7.31431 | 0.477275 | standard |
| 7.31984 | 0.378034 | standard |
| 7.33345 | 0.386048 | standard |
| 7.33979 | 0.375259 | standard |
| 7.36103 | 0.321399 | standard |
| 7.36749 | 0.356389 | standard |
| 7.38102 | 0.395425 | standard |
| 7.38672 | 0.498908 | standard |
| 7.40579 | 0.204864 | standard |
| 7.41201 | 0.186242 | standard |
| 7.61455 | 0.549961 | standard |
| 7.62095 | 0.572011 | standard |
| 7.6335 | 1.00005 | standard |
| 7.63963 | 0.968197 | standard |
| 7.65252 | 0.522839 | standard |
| 7.65879 | 0.477552 | standard |
| -0.787498 | 1.125e-06 | standard |
| 5.56236 | 0.807331 | standard |
| 7.29654 | 0.190272 | standard |
| 7.30096 | 0.205102 | standard |
| 7.31546 | 0.498578 | standard |
| 7.31934 | 0.380589 | standard |
| 7.33005 | 0.367005 | standard |
| 7.33446 | 0.354598 | standard |
| 7.36674 | 0.313233 | standard |
| 7.37128 | 0.342145 | standard |
| 7.38193 | 0.400072 | standard |
| 7.38582 | 0.517047 | standard |
| 7.40032 | 0.227194 | standard |
| 7.40486 | 0.209356 | standard |
| 7.61766 | 0.554395 | standard |
| 7.62214 | 0.565612 | standard |
| 7.63647 | 1.00003 | standard |
| 7.65087 | 0.522663 | standard |
| 7.65542 | 0.49499 | standard |
| -0.976943 | 1.125e-06 | standard |
| 5.56236 | 1.0 | standard |
| 7.30084 | 0.252828 | standard |
| 7.30435 | 0.269715 | standard |
| 7.316 | 0.625174 | standard |
| 7.31893 | 0.470873 | standard |
| 7.32773 | 0.430267 | standard |
| 7.33123 | 0.41175 | standard |
| 7.37015 | 0.37436 | standard |
| 7.37378 | 0.401275 | standard |
| 7.38233 | 0.481707 | standard |
| 7.38547 | 0.629066 | standard |
| 7.39714 | 0.293016 | standard |
| 7.40064 | 0.274059 | standard |
| 7.6195 | 0.66911 | standard |
| 7.62301 | 0.687122 | standard |
| 7.63138 | 0.706628 | standard |
| 7.63551 | 0.862864 | standard |
| 7.63745 | 0.888467 | standard |
| 7.64142 | 0.743514 | standard |
| 7.64988 | 0.642873 | standard |
| 7.65339 | 0.619314 | standard |
| 5.56236 | 1.0 | standard |
| 7.30368 | 0.264697 | standard |
| 7.30654 | 0.28053 | standard |
| 7.31625 | 0.624466 | standard |
| 7.31872 | 0.46182 | standard |
| 7.32612 | 0.414475 | standard |
| 7.32898 | 0.397464 | standard |
| 7.3725 | 0.370361 | standard |
| 7.37548 | 0.390873 | standard |
| 7.38267 | 0.478165 | standard |
| 7.38525 | 0.632915 | standard |
| 7.39493 | 0.298096 | standard |
| 7.39792 | 0.280277 | standard |
| 7.62077 | 0.665049 | standard |
| 7.62362 | 0.688008 | standard |
| 7.63065 | 0.674448 | standard |
| 7.63355 | 0.687433 | standard |
| 7.63914 | 0.718914 | standard |
| 7.64215 | 0.702424 | standard |
| 7.64917 | 0.642857 | standard |
| 7.65203 | 0.621768 | standard |
| 5.56236 | 1.0 | standard |
| 7.30564 | 0.274149 | standard |
| 7.30804 | 0.288916 | standard |
| 7.31652 | 0.629468 | standard |
| 7.32492 | 0.404907 | standard |
| 7.32731 | 0.388906 | standard |
| 7.37416 | 0.364581 | standard |
| 7.37668 | 0.383377 | standard |
| 7.38296 | 0.473787 | standard |
| 7.38508 | 0.631658 | standard |
| 7.39343 | 0.303975 | standard |
| 7.39596 | 0.28718 | standard |
| 7.62162 | 0.655486 | standard |
| 7.62414 | 0.677515 | standard |
| 7.63012 | 0.658451 | standard |
| 7.63265 | 0.651169 | standard |
| 7.64005 | 0.684315 | standard |
| 7.64257 | 0.687931 | standard |
| 7.64867 | 0.64511 | standard |
| 7.65106 | 0.625714 | standard |
| 5.56236 | 1.0 | standard |
| 7.30641 | 0.27514 | standard |
| 7.30875 | 0.290819 | standard |
| 7.31651 | 0.626 | standard |
| 7.32441 | 0.396944 | standard |
| 7.32674 | 0.380785 | standard |
| 7.37484 | 0.362207 | standard |
| 7.37718 | 0.380043 | standard |
| 7.38327 | 0.474992 | standard |
| 7.38508 | 0.631505 | standard |
| 7.39283 | 0.306804 | standard |
| 7.39517 | 0.290231 | standard |
| 7.62203 | 0.662385 | standard |
| 7.62423 | 0.682318 | standard |
| 7.62991 | 0.65519 | standard |
| 7.63225 | 0.644308 | standard |
| 7.64045 | 0.67594 | standard |
| 7.64278 | 0.683924 | standard |
| 7.64847 | 0.646883 | standard |
| 7.65067 | 0.627865 | standard |
| 5.56236 | 1.0 | standard |
| 7.3071 | 0.279394 | standard |
| 7.30925 | 0.294508 | standard |
| 7.31657 | 0.631099 | standard |
| 7.3239 | 0.391124 | standard |
| 7.32616 | 0.374426 | standard |
| 7.37542 | 0.357258 | standard |
| 7.37769 | 0.375452 | standard |
| 7.38502 | 0.635945 | standard |
| 7.39234 | 0.309597 | standard |
| 7.39448 | 0.293757 | standard |
| 7.6223 | 0.655987 | standard |
| 7.62444 | 0.676459 | standard |
| 7.62971 | 0.656193 | standard |
| 7.63185 | 0.642682 | standard |
| 7.64074 | 0.668408 | standard |
| 7.64294 | 0.678121 | standard |
| 7.64825 | 0.642801 | standard |
| 7.65039 | 0.623558 | standard |
| 5.56236 | 1.0 | standard |
| 7.30816 | 0.281546 | standard |
| 7.31015 | 0.296687 | standard |
| 7.31666 | 0.633825 | standard |
| 7.32319 | 0.385474 | standard |
| 7.32518 | 0.369531 | standard |
| 7.37652 | 0.35973 | standard |
| 7.37838 | 0.376047 | standard |
| 7.38491 | 0.633692 | standard |
| 7.39143 | 0.310553 | standard |
| 7.39342 | 0.294499 | standard |
| 7.62278 | 0.64688 | standard |
| 7.62476 | 0.667573 | standard |
| 7.62939 | 0.648011 | standard |
| 7.63138 | 0.631423 | standard |
| 7.64133 | 0.667251 | standard |
| 7.64319 | 0.680213 | standard |
| 7.64795 | 0.64614 | standard |
| 7.64981 | 0.627593 | standard |
| 5.56236 | 1.0 | standard |
| 7.30865 | 0.288147 | standard |
| 7.31056 | 0.303653 | standard |
| 7.31665 | 0.625826 | standard |
| 7.3229 | 0.386469 | standard |
| 7.32468 | 0.371208 | standard |
| 7.3769 | 0.356451 | standard |
| 7.37868 | 0.372337 | standard |
| 7.38492 | 0.634197 | standard |
| 7.39114 | 0.313576 | standard |
| 7.39292 | 0.298945 | standard |
| 7.62308 | 0.652974 | standard |
| 7.62485 | 0.672628 | standard |
| 7.6293 | 0.661941 | standard |
| 7.63107 | 0.638595 | standard |
| 7.64152 | 0.661471 | standard |
| 7.6433 | 0.67487 | standard |
| 7.64785 | 0.643239 | standard |
| 7.64962 | 0.625156 | standard |
| 5.56236 | 1.0 | standard |
| 7.30916 | 0.294988 | standard |
| 7.31084 | 0.309405 | standard |
| 7.31672 | 0.63556 | standard |
| 7.3226 | 0.379001 | standard |
| 7.32429 | 0.363653 | standard |
| 7.3773 | 0.356054 | standard |
| 7.37898 | 0.371838 | standard |
| 7.38493 | 0.628814 | standard |
| 7.39073 | 0.312144 | standard |
| 7.39254 | 0.296493 | standard |
| 7.62327 | 0.641671 | standard |
| 7.62495 | 0.660538 | standard |
| 7.6292 | 0.66387 | standard |
| 7.63088 | 0.648106 | standard |
| 7.64172 | 0.660756 | standard |
| 7.6434 | 0.674661 | standard |
| 7.64774 | 0.644869 | standard |
| 7.64942 | 0.627024 | standard |
| 5.56236 | 1.0 | standard |
| 7.30983 | 0.294065 | standard |
| 7.31146 | 0.30921 | standard |
| 7.31676 | 0.622809 | standard |
| 7.32209 | 0.371688 | standard |
| 7.32371 | 0.355685 | standard |
| 7.37798 | 0.355198 | standard |
| 7.37948 | 0.370141 | standard |
| 7.38487 | 0.639807 | standard |
| 7.39024 | 0.319066 | standard |
| 7.39174 | 0.305119 | standard |
| 7.62355 | 0.632576 | standard |
| 7.62517 | 0.652195 | standard |
| 7.62898 | 0.654567 | standard |
| 7.6306 | 0.637245 | standard |
| 7.64211 | 0.660555 | standard |
| 7.6436 | 0.67531 | standard |
| 7.64754 | 0.64872 | standard |
| 7.64903 | 0.631087 | standard |
| 5.56236 | 1.0 | standard |
| 7.31102 | 0.306532 | standard |
| 7.31224 | 0.319728 | standard |
| 7.31681 | 0.628 | standard |
| 7.32139 | 0.366883 | standard |
| 7.32273 | 0.351913 | standard |
| 7.37895 | 0.351917 | standard |
| 7.38029 | 0.367201 | standard |
| 7.3848 | 0.639411 | standard |
| 7.38933 | 0.314965 | standard |
| 7.39067 | 0.299864 | standard |
| 7.62415 | 0.648436 | standard |
| 7.62536 | 0.665311 | standard |
| 7.62867 | 0.654003 | standard |
| 7.63002 | 0.636713 | standard |
| 7.64258 | 0.63671 | standard |
| 7.64392 | 0.654 | standard |
| 7.64724 | 0.665307 | standard |
| 7.64845 | 0.64843 | standard |