SpectraBase Spectrum ID |
Huxw5wsLksB |
Name |
R-2-Hydroxy-2,T-3-diphenylindan-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
300.115029753 u |
Formula |
C21H16O2 |
InChI |
InChI=1S/C21H16O2/c22-20-18-14-8-7-13-17(18)19(15-9-3-1-4-10-15)21(20,23)16-11-5-2-6-12-16/h1-14,19,23H/t19-,21+/m1/s1 |
InChIKey |
LBMSPIWISCKOGC-CTNGQTDRSA-N |
SMILES |
[C@]1(C(C=2C=CC=CC2[C@]1(C1=CC=CC=C1)[H])=O)(C1=CC=CC=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940935 |