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

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

cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(phenethyl) ester
SpectraBase Compound ID 1lofiLWNzLI
InChI InChI=1S/C24H26O4/c25-23(27-17-15-19-9-3-1-4-10-19)21-13-7-8-14-22(21)24(26)28-18-16-20-11-5-2-6-12-20/h1-12,21-22H,13-18H2
InChIKey YCHDRXYELNNBCE-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CClJCWuRYHn
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(phenethyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 378.183109313 u
Formula C24H26O4
InChI InChI=1S/C24H26O4/c25-23(27-17-15-19-9-3-1-4-10-19)21-13-7-8-14-22(21)24(26)28-18-16-20-11-5-2-6-12-20/h1-12,21-22H,13-18H2
InChIKey YCHDRXYELNNBCE-UHFFFAOYSA-N
Molecular Weight 378.468 g/mol
SMILES C=1CC(C(CC1)C(OCCC=1C=CC=CC1)=O)C(=O)OCCC1=CC=CC=C1