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Oleic acid, 3-hydroxypropyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Oleic acid, 3-hydroxypropyl ester
SpectraBase Compound ID 37lNFDxXd4l
InChI InChI=1S/C21H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)24-20-17-19-22/h9-10,22H,2-8,11-20H2,1H3/b10-9-
InChIKey YWBLIYFXWVRDAA-KTKRTIGZSA-N
Mol Weight 340.5 g/mol
Molecular Formula C21H40O3
Exact Mass 340.297745 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HHoaPtcO1tj
Name Oleic acid, 3-hydroxypropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.297745145 u
Formula C21H40O3
InChI InChI=1S/C21H40O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(23)24-20-17-19-22/h9-10,22H,2-8,11-20H2,1H3/b10-9-
InChIKey YWBLIYFXWVRDAA-KTKRTIGZSA-N
Molecular Weight 340.548 g/mol
SMILES C(CCCCCC\C=C/CCCCCCCC)C(OCCCO)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956734