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14-Hydroxy-15-methylhexadec-15-enoic acid, ethyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

14-Hydroxy-15-methylhexadec-15-enoic acid, ethyl ester
SpectraBase Compound ID Ed6tQp0Jv7X
InChI InChI=1S/C19H36O3/c1-4-22-19(21)16-14-12-10-8-6-5-7-9-11-13-15-18(20)17(2)3/h18,20H,2,4-16H2,1,3H3
InChIKey OYJVUWAAUOMDRL-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C19H36O3
Exact Mass 312.266445 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1ScmlXKP35a
Name 14-Hydroxy-15-methylhexadec-15-enoic acid, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.266445016 u
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-4-22-19(21)16-14-12-10-8-6-5-7-9-11-13-15-18(20)17(2)3/h18,20H,2,4-16H2,1,3H3
InChIKey OYJVUWAAUOMDRL-UHFFFAOYSA-N
SMILES C(=O)(OCC)CCCCCCCCCCCCC(C(=C)C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959315