For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(2-methylbutyl) ester

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

cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(2-methylbutyl) ester
SpectraBase Compound ID 3JnrsdWWWUU
InChI InChI=1S/C18H30O4/c1-5-13(3)11-21-17(19)15-9-7-8-10-16(15)18(20)22-12-14(4)6-2/h7-8,13-16H,5-6,9-12H2,1-4H3
InChIKey DZWIAYAUFVOENZ-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 78P5fA0tpjP
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(2-methylbutyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.214409442 u
Formula C18H30O4
InChI InChI=1S/C18H30O4/c1-5-13(3)11-21-17(19)15-9-7-8-10-16(15)18(20)22-12-14(4)6-2/h7-8,13-16H,5-6,9-12H2,1-4H3
InChIKey DZWIAYAUFVOENZ-UHFFFAOYSA-N
SMILES C=1CC(C(CC1)C(OCC(CC)C)=O)C(=O)OCC(CC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.983581