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Dimethyl 3-isopropyl-4-(3-methyl-1-butenyl)-1-cyclohexene-1,4-dicarboxylate

View entire compound with spectra: 1 MS (GC)

Dimethyl 3-isopropyl-4-(3-methyl-1-butenyl)-1-cyclohexene-1,4-dicarboxylate
SpectraBase Compound ID AAQkvMDpihF
InChI InChI=1S/C18H28O4/c1-12(2)7-9-18(17(20)22-6)10-8-14(16(19)21-5)11-15(18)13(3)4/h7,9,11-13,15H,8,10H2,1-6H3/b9-7+
InChIKey BQCOJKMFMITWCC-VQHVLOKHSA-N
Mol Weight 308.42 g/mol
Molecular Formula C18H28O4
Exact Mass 308.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EuesVjfq4D
Name Dimethyl 3-isopropyl-4-(3-methyl-1-butenyl)-1-cyclohexene-1,4-dicarboxylate
CAS Registry Number 115266-59-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O4
InChI InChI=1S/C18H28O4/c1-12(2)7-9-18(17(20)22-6)10-8-14(16(19)21-5)11-15(18)13(3)4/h7,9,11-13,15H,8,10H2,1-6H3/b9-7+
InChIKey BQCOJKMFMITWCC-VQHVLOKHSA-N
Molecular Weight 308.418 g/mol
SMILES C1(C(C=C(CC1)C(=O)OC)C(C)C)(\C=C\C(C)C)C(=O)OC
SPLASH splash10-00mw-7970000000-7067c1e495ff735e4b5c
Source of Spectrum J-53-3707-6
Synonyms Dimethyl 3-isopropyl-4-[(1E)-3-methyl-1-butenyl]-1-cyclohexene-1,4-dicarboxylate
Wiley ID 1309913