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Methyl 2-hydroxy-16-methyl-heptadecanoate

View entire compound with spectra: 1 NMR, and 1 FTIR

Methyl 2-hydroxy-16-methyl-heptadecanoate
SpectraBase Compound ID AwrYpeUGK4H
InChI InChI=1S/C19H38O3/c1-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18(20)19(21)22-3/h17-18,20H,4-16H2,1-3H3
InChIKey LQQSDKLQWLZECG-UHFFFAOYSA-N
Mol Weight 314.5 g/mol
Molecular Formula C19H38O3
Exact Mass 314.282095 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AuUESatr9Cn
Name Methyl 2-hydroxy-16-methyl-heptadecanoate
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/c1-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18(20)19(21)22-3/h17-18,20H,4-16H2,1-3H3
InChIKey LQQSDKLQWLZECG-UHFFFAOYSA-N
Molecular Weight 314.510 g/mol
SMILES C(CCCCCCCCCC(C(=O)OC)O)CCCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912914