| SpectraBase Spectrum ID |
9rQkejFXfoh |
| Name |
14,15,16-Trinor-8.xi.-labdan-6.beta.-ol, 8,13-epoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.224580204 u |
| Formula |
C17H30O2 |
| InChI |
InChI=1S/C17H30O2/c1-15(2)8-6-9-16(3)13-7-5-10-19-17(13,4)11-12(18)14(15)16/h12-14,18H,5-11H2,1-4H3 |
| InChIKey |
PJZDQIGNLCWGIY-UHFFFAOYSA-N |
| Molecular Weight |
266.425 g/mol |
| SMILES |
CC12C3C(C)(CC(C2C(C)(C)CCC1)O)OCCC3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956125 |
