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Glutaric acid, (cyclohex-3-enyl)methyl 3-methylbut-2-en-1-yl ester

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

Glutaric acid, (cyclohex-3-enyl)methyl 3-methylbut-2-en-1-yl ester
SpectraBase Compound ID FW5mDgZtRRm
InChI InChI=1S/C17H26O4/c1-14(2)11-12-20-16(18)9-6-10-17(19)21-13-15-7-4-3-5-8-15/h3-4,11,15H,5-10,12-13H2,1-2H3
InChIKey WJMFVDLMUDJDBV-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GxuYFQpLYjW
Name Glutaric acid, (cyclohex-3-enyl)methyl 3-methylbut-2-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.183109313 u
Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-14(2)11-12-20-16(18)9-6-10-17(19)21-13-15-7-4-3-5-8-15/h3-4,11,15H,5-10,12-13H2,1-2H3
InChIKey WJMFVDLMUDJDBV-UHFFFAOYSA-N
SMILES C(CCC(OCC=C(C)C)=O)C(OCC1CC=CCC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905444