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Succinic acid, isobutyl non-4-enyl ester

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

Succinic acid, isobutyl non-4-enyl ester
SpectraBase Compound ID 5hz4qUVAbdL
InChI InChI=1S/C17H30O4/c1-4-5-6-7-8-9-10-13-20-16(18)11-12-17(19)21-14-15(2)3/h7-8,15H,4-6,9-14H2,1-3H3/b8-7+
InChIKey QDEHLBOWDKNJNU-BQYQJAHWSA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JILIQQGeyrp
Name Succinic acid, isobutyl non-4-enyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 298.214409442 u
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-4-5-6-7-8-9-10-13-20-16(18)11-12-17(19)21-14-15(2)3/h7-8,15H,4-6,9-14H2,1-3H3/b8-7+
InChIKey QDEHLBOWDKNJNU-BQYQJAHWSA-N
SMILES CCCC\C=C\CCCOC(CCC(OCC(C)C)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928117