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Diethyl 3-(2'-Bromobenzamido)-5-methylcyclohex-4-ene-1,2-dicarboxylate
SpectraBase Compound ID 9cBdKnRnjnl
InChI InChI=1S/C20H24BrNO5/c1-4-26-19(24)14-10-12(3)11-16(17(14)20(25)27-5-2)22-18(23)13-8-6-7-9-15(13)21/h6-9,11,14,16-17H,4-5,10H2,1-3H3,(H,22,23)
InChIKey DOFMAQDCVIWMBR-UHFFFAOYSA-N
Mol Weight 438.32 g/mol
Molecular Formula C20H24BrNO5
Exact Mass 437.083786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JO8EVC8dVBL
Name Diethyl 3-(2'-Bromobenzamido)-5-methylcyclohex-4-ene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24BrNO5
InChI InChI=1S/C20H24BrNO5/c1-4-26-19(24)14-10-12(3)11-16(17(14)20(25)27-5-2)22-18(23)13-8-6-7-9-15(13)21/h6-9,11,14,16-17H,4-5,10H2,1-3H3,(H,22,23)
InChIKey DOFMAQDCVIWMBR-UHFFFAOYSA-N
Molecular Weight 438.318 g/mol
SMILES N(C(c1c(Br)cccc1)=O)C1C(C(C(=O)OCC)CC(=C1)C)C(=O)OCC
SPLASH splash10-0016-1950000000-fe352a9155be81abed13
Source of Spectrum F4-0-2035-7
Synonyms Diethyl 3-[(2-bromobenzoyl)amino]-5-methyl-4-cyclohexene-1,2-dicarboxylate
Wiley ID 1618465