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3-Phenyl-4-[(E)-2-phenylethenyl]cyclohexene-1,4-dicarboxylic acid diethyl ester
SpectraBase Compound ID 5coYSTTyp84
InChI InChI=1S/C26H28O4/c1-3-29-24(27)22-16-18-26(25(28)30-4-2,17-15-20-11-7-5-8-12-20)23(19-22)21-13-9-6-10-14-21/h5-15,17,19,23H,3-4,16,18H2,1-2H3/b17-15+
InChIKey QKELKGFALTVSFY-BMRADRMJSA-N
Mol Weight 404.51 g/mol
Molecular Formula C26H28O4
Exact Mass 404.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxqxxMszszh
Name 3-Phenyl-4-[(E)-2-phenylethenyl]cyclohexene-1,4-dicarboxylic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O4
InChI InChI=1S/C26H28O4/c1-3-29-24(27)22-16-18-26(25(28)30-4-2,17-15-20-11-7-5-8-12-20)23(19-22)21-13-9-6-10-14-21/h5-15,17,19,23H,3-4,16,18H2,1-2H3/b17-15+
InChIKey QKELKGFALTVSFY-BMRADRMJSA-N
Molecular Weight 404.506 g/mol
SMILES C1(C(C=C(CC1)C(=O)OCC)c1ccccc1)(\C=C\c1ccccc1)C(=O)OCC
SPLASH splash10-0udi-0900000000-c2b1164580befeb8b645
Source of Spectrum SO-0-283-1
Synonyms 3-Phenyl-4-[(E)-styryl]cyclohexene-1,4-dicarboxylic acid diethyl ester Diethyl 3-phenyl-4-[(E)-2-phenylethenyl]cyclohexene-1,4-dicarboxylate Diethyl 3-phenyl-4-[(E)-styryl]cyclohexene-1,4-dicarboxylate
Wiley ID 876329