| SpectraBase Spectrum ID |
FPGyk86MVEp |
| Name |
(1-R*,3A-R*,7A-S*)-1-Hydroxy-3A,7,7-trimethyl-3-phenyl-1,3A,4,6,7-hexahydro-inden-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.161979946 u |
| Formula |
C18H22O2 |
| InChI |
InChI=1S/C18H22O2/c1-17(2)10-13(19)11-18(3)14(9-15(20)16(17)18)12-7-5-4-6-8-12/h4-9,15-16,20H,10-11H2,1-3H3/t15-,16+,18+/m1/s1 |
| InChIKey |
KVRFCXSMBIMVLQ-RYRKJORJSA-N |
| Molecular Weight |
270.372 g/mol |
| SMILES |
[C@]1(O)(C=C([C@]2(C)CC(=O)CC([C@]12[H])(C)C)C1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936873 |
