| SpectraBase Spectrum ID |
2i3uqMnSY2T |
| Name |
(+-)-(4as*,9S*,9as*)-6,8-dimethyl-7-hydroxy-9-phenyl-1,2,3,4,4A,9,9A-heptahydroflurene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.182715392 u |
| Formula |
C21H24O |
| InChI |
InChI=1S/C21H24O/c1-13-12-18-16-10-6-7-11-17(16)20(15-8-4-3-5-9-15)19(18)14(2)21(13)22/h3-5,8-9,12,16-17,20,22H,6-7,10-11H2,1-2H3/t16-,17-,20+/m0/s1 |
| InChIKey |
OWQRPLZCBLYOCW-ABSDTBQOSA-N |
| SMILES |
C12=C([C@]3(CCCC[C@@]3([C@]2(C=2C=CC=CC2)[H])[H])[H])C=C(C(=C1C)O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90149 |
