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Methyl 5,12-octadecadienoate

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

Methyl 5,12-octadecadienoate
SpectraBase Compound ID 8BHUGzWHBWl
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,14-15H,3-6,9-13,16-18H2,1-2H3/b8-7-,15-14-
InChIKey DAUUEOZZFXEZSR-XWUSKMMESA-N
Mol Weight 294.5 g/mol
Molecular Formula C19H34O2
Exact Mass 294.25588 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1jOFQsW0nvx
Name Methyl 5,12-octadecadienoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.255880333 u
Formula C19H34O2
InChI InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,14-15H,3-6,9-13,16-18H2,1-2H3/b8-7-,15-14-
InChIKey DAUUEOZZFXEZSR-XWUSKMMESA-N
SMILES C(CC\C=C/CCCCC\C=C/CCCCC)C(OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.975659