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Methyl 5,9-heptadecadienoate

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

Methyl 5,9-heptadecadienoate
SpectraBase Compound ID 82p9RmpAwVu
InChI InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h9-10,13-14H,3-8,11-12,15-17H2,1-2H3/b10-9-,14-13-
InChIKey GCSGGKAPVXWRNU-KWUOUXIESA-N
Mol Weight 280.5 g/mol
Molecular Formula C18H32O2
Exact Mass 280.24023 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DLBMQpg4ec
Name Methyl 5,9-heptadecadienoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.240230268 u
Formula C18H32O2
InChI InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h9-10,13-14H,3-8,11-12,15-17H2,1-2H3/b10-9-,14-13-
InChIKey GCSGGKAPVXWRNU-KWUOUXIESA-N
SMILES C(CC\C=C/CC\C=C/CCCCCCC)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.990544