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1-Cyclohexene-1-carboxylic acid, 2-[2-(3-methoxy-3-oxo-1-propenyl)-1-methyl-1H-indol-3-yl]-, methyl ester
SpectraBase Compound ID IQEZRmEdbER
InChI InChI=1S/C21H23NO4/c1-22-17-11-7-6-10-16(17)20(18(22)12-13-19(23)25-2)14-8-4-5-9-15(14)21(24)26-3/h6-7,10-13H,4-5,8-9H2,1-3H3/b13-12+
InChIKey OEZNJZDHOCZUKX-OUKQBFOZSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlsmWtWov8A
Name 1-Cyclohexene-1-carboxylic acid, 2-[2-(3-methoxy-3-oxo-1-propenyl)-1-methyl-1H-indol-3-yl]-, methyl ester
CAS Registry Number 130283-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-22-17-11-7-6-10-16(17)20(18(22)12-13-19(23)25-2)14-8-4-5-9-15(14)21(24)26-3/h6-7,10-13H,4-5,8-9H2,1-3H3/b13-12+
InChIKey OEZNJZDHOCZUKX-OUKQBFOZSA-N
Molecular Weight 353.418 g/mol
SMILES c1(c([n](C)c2c1cccc2)\C=C\C(=O)OC)C1=C(C(=O)OC)CCCC1
SPLASH splash10-0ue9-0095000000-d8b0d9306ba7b0b8c4db
Source of Spectrum H-73-837-18
Synonyms Methyl (E)-3-{1'-methyl-3'-[2''-(methoxycarbonyl)cyclohex-2'-en-1-yl]-1'h-indol-2'-yl}prop-2-enoate Methyl 2-{2-[(1E)-3-methoxy-3-oxo-1-propenyl]-1-methyl-1H-indol-3-yl}-1-cyclohexene-1-carboxylate
Wiley ID 1344027