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Succinic acid, cyclohex-2-enylmethyl isobutyl ester

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

Succinic acid, cyclohex-2-enylmethyl isobutyl ester
SpectraBase Compound ID 6qHjnFE5qB1
InChI InChI=1S/C15H24O4/c1-12(2)10-18-14(16)8-9-15(17)19-11-13-6-4-3-5-7-13/h4,6,12-13H,3,5,7-11H2,1-2H3
InChIKey WJBVZBIOCUMGHD-UHFFFAOYSA-N
Mol Weight 268.35 g/mol
Molecular Formula C15H24O4
Exact Mass 268.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BAsam8OYXuW
Name Succinic acid, cyclohex-2-enylmethyl isobutyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.167459249 u
Formula C15H24O4
InChI InChI=1S/C15H24O4/c1-12(2)10-18-14(16)8-9-15(17)19-11-13-6-4-3-5-7-13/h4,6,12-13H,3,5,7-11H2,1-2H3
InChIKey WJBVZBIOCUMGHD-UHFFFAOYSA-N
Molecular Weight 268.353 g/mol
SMILES C(CC(OCC1C=CCCC1)=O)C(OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.877319