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3-Methyl-4-[(E)-prop-1-enyl]cyclohexene-1,4-dicarboxylic acid diethyl ester
SpectraBase Compound ID Br3BrJDYixN
InChI InChI=1S/C16H24O4/c1-5-9-16(15(18)20-7-3)10-8-13(11-12(16)4)14(17)19-6-2/h5,9,11-12H,6-8,10H2,1-4H3/b9-5+
InChIKey RJYUGVXZSFGABM-WEVVVXLNSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ipmFEylzkN
Name 3-Methyl-4-[(E)-prop-1-enyl]cyclohexene-1,4-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 3-methyl-4-[(E)-prop-1-enyl]cyclohexene-1,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-5-9-16(15(18)20-7-3)10-8-13(11-12(16)4)14(17)19-6-2/h5,9,11-12H,6-8,10H2,1-4H3/b9-5+
InChIKey RJYUGVXZSFGABM-WEVVVXLNSA-N
Molecular Weight 280.364 g/mol
SMILES C1(C(C=C(CC1)C(=O)OCC)C)(C(=O)OCC)\C=C\C
SPLASH splash10-01q9-4970000000-60c5d70d6bb9896d986d
Source of Spectrum SO-0-283-1
Wiley ID 876330