SpectraBase Spectrum ID |
KoiU1xeHnZe |
Name |
Methyl-2-hydroxyoctadecanoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
314.282095081 u |
Formula |
C19H38O3 |
InChI |
InChI=1S/C19H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22-2/h18,20H,3-17H2,1-2H3 |
InChIKey |
OUFCLLRNNJZLOX-UHFFFAOYSA-N |
Molecular Weight |
314.510 g/mol |
SMILES |
COC(=O)C(O)CCCCCCCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860162 |