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cis-Cyclohex-4-en-1,2-dicarboxylic acid, phenethyl tetradecyl ester

View entire compound with spectra: 1 NMR

cis-Cyclohex-4-en-1,2-dicarboxylic acid, phenethyl tetradecyl ester
SpectraBase Compound ID IhipBMgp5IE
InChI InChI=1S/C30H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-18-24-33-29(31)27-21-16-17-22-28(27)30(32)34-25-23-26-19-14-13-15-20-26/h13-17,19-20,27-28H,2-12,18,21-25H2,1H3
InChIKey VTGQPRNMRUIRGL-UHFFFAOYSA-N
Mol Weight 470.7 g/mol
Molecular Formula C30H46O4
Exact Mass 470.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2LC7tIYPUwu
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, phenethyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.339609957 u
Formula C30H46O4
InChI InChI=1S/C30H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-18-24-33-29(31)27-21-16-17-22-28(27)30(32)34-25-23-26-19-14-13-15-20-26/h13-17,19-20,27-28H,2-12,18,21-25H2,1H3
InChIKey VTGQPRNMRUIRGL-UHFFFAOYSA-N
Molecular Weight 470.694 g/mol
SMILES C=1CC(C(CC1)C(OCCC=1C=CC=CC1)=O)C(=O)OCCCCCCCCCCCCCC