| SpectraBase Spectrum ID |
8fRz7r77LmP |
| Name |
10-o-Acetyl-15-oxo-.alpha.-cadinol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.188194694 u |
| Formula |
C17H26O3 |
| InChI |
InChI=1S/C17H26O3/c1-11(2)14-7-8-17(4,20-12(3)19)16-6-5-13(10-18)9-15(14)16/h10-11,13-14H,5-9H2,1-4H3 |
| InChIKey |
PPYLNSODBPJHFD-UHFFFAOYSA-N |
| Molecular Weight |
278.392 g/mol |
| SMILES |
C12=C(C(OC(=O)C)(C)CCC2C(C)C)CCC(C=O)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95387 |
