SpectraBase Spectrum ID |
IGPSgcSt6ws |
Name |
Glycerol monooleate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
356.292659764 u |
Formula |
C21H40O4 |
InChI |
InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9- |
InChIKey |
RZRNAYUHWVFMIP-KTKRTIGZSA-N |
Molecular Weight |
356.547 g/mol |
SMILES |
OCC(COC(CCCCCCC\C=C/CCCCCCCC)=O)O |
Spectrum/Structure Validation Score (Raman) |
0.993487 |