| SpectraBase Spectrum ID |
3NsvBtNg2wu |
| Name |
Desoxy-isosteviol methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.255880333 u |
| Formula |
C21H34O2 |
| InChI |
InChI=1S/C21H34O2/c1-18-10-6-16-19(2)8-5-9-20(3,17(22)23-4)15(19)7-11-21(16,14-18)13-12-18/h15-16H,5-14H2,1-4H3 |
| InChIKey |
AZAWGQDWZYPVNZ-UHFFFAOYSA-N |
| Molecular Weight |
318.501 g/mol |
| SMILES |
COC(=O)C1(C)C2C(C)(CCC1)C1C3(CCC(C)(CC1)C3)CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.807252 |
