| SpectraBase Spectrum ID |
AmX30zm63zf |
| Name |
Methyl 5-oxo-1.alpha.,4A.beta.-dimethyl-2.beta.-methoxy-1,2,3,4,4A,5,6,7,8,8A.alpha.-decahydronaphthalene-1.beta.-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
268.167459249 u |
| Formula |
C15H24O4 |
| InChI |
InChI=1S/C15H24O4/c1-14-9-8-12(18-3)15(2,13(17)19-4)10(14)6-5-7-11(14)16/h10,12H,5-9H2,1-4H3/t10?,12-,14-,15+/m0/s1 |
| InChIKey |
SMWIWHFMTDVZPB-DVIPZNOOSA-N |
| Molecular Weight |
268.353 g/mol |
| SMILES |
[C@@]1(C2[C@](C(=O)CCC2)(C)CC[C@@]1(OC)[H])(C(=O)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847892 |
