| SpectraBase Spectrum ID |
B8xk08eabVm |
| Name |
Acetic acid (1R,4ar,8as)-6,7,8A-trimethyl-1,2,3,4,4A,5,8,8A-octahydro-naphthalen-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-10-8-13-6-5-7-14(17-12(3)16)15(13,4)9-11(10)2/h13-14H,5-9H2,1-4H3/t13-,14-,15+/m1/s1 |
| InChIKey |
PVWBWIAGVMCHFY-KFWWJZLASA-N |
| Molecular Weight |
236.355 g/mol |
| SMILES |
[C@]12(CC(C)=C(C[C@]2(CCC[C@]1(OC(=O)C)[H])[H])C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.846615 |
