SpectraBase Spectrum ID |
LVkP6kiUY0m |
Name |
Bicyclo[3.2.0]hept-2-en-6-ol, 7-(diphenylmethylene)-6-phenyl-, (1.alpha.,5.alpha.,6.alpha.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.167065327 u |
Formula |
C26H22O |
InChI |
InChI=1S/C26H22O/c27-26(21-15-8-3-9-16-21)23-18-10-17-22(23)25(26)24(19-11-4-1-5-12-19)20-13-6-2-7-14-20/h1-17,22-23,27H,18H2/t22-,23+,26+/m0/s1 |
InChIKey |
HNCNGMWBMPSEKH-PPJWLVRDSA-N |
Molecular Weight |
350.461 g/mol |
SMILES |
C1([C@](C2=CC=CC=C2)(O)[C@]2([C@@]1(C=CC2)[H])[H])=C(C1=CC=CC=C1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973084 |