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Methyl 5,9-tricosadienoate

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

Methyl 5,9-tricosadienoate
SpectraBase Compound ID 5UNzxCXr2Z1
InChI InChI=1S/C24H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h15-16,19-20H,3-14,17-18,21-23H2,1-2H3/b16-15+,20-19+
InChIKey BPMDJBLHOBBFPO-LMOVRVBNSA-N
Mol Weight 364.6 g/mol
Molecular Formula C24H44O2
Exact Mass 364.334131 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CDoooL1w9oY
Name Methyl 5,9-tricosadienoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.334130655 u
Formula C24H44O2
InChI InChI=1S/C24H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h15-16,19-20H,3-14,17-18,21-23H2,1-2H3/b16-15+,20-19+
InChIKey BPMDJBLHOBBFPO-LMOVRVBNSA-N
Molecular Weight 364.614 g/mol
SMILES C(CCC\C=C\CC\C=C\CCCCCCCCCCCCC)(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909005