SpectraBase Spectrum ID |
JQrxdWG4ClJ |
Name |
Propylene glycol monostearate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
342.313395209 u |
Formula |
C21H42O3 |
InChI |
InChI=1S/C21H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(23)24-19-20(2)22/h20,22H,3-19H2,1-2H3 |
InChIKey |
FKOKUHFZNIUSLW-UHFFFAOYSA-N |
Molecular Weight |
342.564 g/mol |
SMILES |
OC(COC(CCCCCCCCCCCCCCCCC)=O)C |
Spectrum/Structure Validation Score (Raman) |
0.991488 |