| SpectraBase Spectrum ID |
K3JCfLEpTK2 |
| Name |
(1S*,2S*)-6-Hydroxy-1-(4-methoxyphenyl)-2,3,3,5,7-pentamethyl-1,2-dihydroindene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.193280075 u |
| Formula |
C21H26O2 |
| InChI |
InChI=1S/C21H26O2/c1-12-11-17-18(13(2)20(12)22)19(14(3)21(17,4)5)15-7-9-16(23-6)10-8-15/h7-11,14,19,22H,1-6H3/t14-,19-/m0/s1 |
| InChIKey |
YFXGYUMCOYLLFZ-LIRRHRJNSA-N |
| SMILES |
C12=C(C(C)(C)[C@]([C@]2(C=2C=CC(=CC2)OC)[H])(C)[H])C=C(C(=C1C)O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932605 |
