| SpectraBase Spectrum ID |
EYzJnPvO0yX |
| Name |
Methyl 16-methyloctadec-9-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.287180462 u |
| Formula |
C20H38O2 |
| InChI |
InChI=1S/C20H38O2/c1-4-19(2)17-15-13-11-9-7-5-6-8-10-12-14-16-18-20(21)22-3/h5,7,19H,4,6,8-18H2,1-3H3/b7-5+ |
| InChIKey |
SMMJEVXBEICFLC-FNORWQNLSA-N |
| Molecular Weight |
310.522 g/mol |
| SMILES |
C(=O)(OC)CCCCCCC\C=C\CCCCCC(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943387 |
