| SpectraBase Spectrum ID |
H91Ox7eNYDJ |
| Name |
(S)-Ethyl 3-methyl-5-((4as,8as)-2,5,5,8A-tetramethyl-3,4,4A,5,6,7,8,8A-octahydronaphthalen-1-yl)pentanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.287180462 u |
| Formula |
C22H38O2 |
| InChI |
InChI=1S/C22H38O2/c1-7-24-20(23)15-16(2)9-11-18-17(3)10-12-19-21(4,5)13-8-14-22(18,19)6/h16,19H,7-15H2,1-6H3/t16-,19-,22+/m1/s1 |
| InChIKey |
DLCQYCQEAHRTEG-PERKRYKHSA-N |
| Molecular Weight |
334.544 g/mol |
| SMILES |
[C@@]12([C@](C(=C(CC2)C)CC[C@](CC(OCC)=O)(C)[H])(CCCC1(C)C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.984193 |
