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4-[(E)-but-1-enyl]-3-ethyl-cyclohexene-1,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 5PVO0JISYUf
InChI InChI=1S/C16H24O4/c1-5-7-9-16(15(18)20-4)10-8-12(14(17)19-3)11-13(16)6-2/h7,9,11,13H,5-6,8,10H2,1-4H3/b9-7+
InChIKey ZJYNXWKCQICQJK-VQHVLOKHSA-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 CTd8rbEjSDF
Name 4-[(E)-but-1-enyl]-3-ethyl-cyclohexene-1,4-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 4-[(E)-but-1-enyl]-3-ethyl-cyclohexene-1,4-dicarboxylate 4-[(E)-but-1-enyl]-3-ethylcyclohexene-1,4-dicarboxylic acid dimethyl ester
CAS Registry Number 115205-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-5-7-9-16(15(18)20-4)10-8-12(14(17)19-3)11-13(16)6-2/h7,9,11,13H,5-6,8,10H2,1-4H3/b9-7+
InChIKey ZJYNXWKCQICQJK-VQHVLOKHSA-N
Molecular Weight 280.364 g/mol
SMILES C1(C(C=C(CC1)C(=O)OC)CC)(C(=O)OC)\C=C\CC
SPLASH splash10-004m-6960000000-f6606914103f6c9f1157
Source of Spectrum J-53-3707-6
Wiley ID 1283969