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cis-Cyclohex-4-en-1,2-dicarboxylic acid, pentadecyl undecyl ester

View entire compound with spectra: 1 NMR

cis-Cyclohex-4-en-1,2-dicarboxylic acid, pentadecyl undecyl ester
SpectraBase Compound ID Itk6qMsO0Yo
InChI InChI=1S/C34H62O4/c1-3-5-7-9-11-13-14-15-16-18-20-22-26-30-38-34(36)32-28-24-23-27-31(32)33(35)37-29-25-21-19-17-12-10-8-6-4-2/h23-24,31-32H,3-22,25-30H2,1-2H3
InChIKey DWITZNSWIVYRHN-UHFFFAOYSA-N
Mol Weight 534.9 g/mol
Molecular Formula C34H62O4
Exact Mass 534.46481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1coxMpb60jD
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, pentadecyl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 534.464810472 u
Formula C34H62O4
InChI InChI=1S/C34H62O4/c1-3-5-7-9-11-13-14-15-16-18-20-22-26-30-38-34(36)32-28-24-23-27-31(32)33(35)37-29-25-21-19-17-12-10-8-6-4-2/h23-24,31-32H,3-22,25-30H2,1-2H3
InChIKey DWITZNSWIVYRHN-UHFFFAOYSA-N
Molecular Weight 534.866 g/mol
SMILES C=1CC(C(CC1)C(OCCCCCCCCCCC)=O)C(=O)OCCCCCCCCCCCCCCC