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Dimethyl 1-[(1E)-3-methoxy-1-(methoxycarbonyl)-3-oxo-1-propenyl]-2,5-dimethyl-1H-1-benzazepine-3,4-dicarboxylate
SpectraBase Compound ID EMNotH1OulY
InChI InChI=1S/C22H23NO8/c1-12-14-9-7-8-10-15(14)23(16(20(25)29-4)11-17(24)28-3)13(2)19(22(27)31-6)18(12)21(26)30-5/h7-11H,1-6H3/b16-11+
InChIKey KRPIEYXZXCLMNT-LFIBNONCSA-N
Mol Weight 429.43 g/mol
Molecular Formula C22H23NO8
Exact Mass 429.142367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ft218q17WfL
Name Dimethyl 1-[(1E)-3-methoxy-1-(methoxycarbonyl)-3-oxo-1-propenyl]-2,5-dimethyl-1H-1-benzazepine-3,4-dicarboxylate
CAS Registry Number 126680-55-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO8
InChI InChI=1S/C22H23NO8/c1-12-14-9-7-8-10-15(14)23(16(20(25)29-4)11-17(24)28-3)13(2)19(22(27)31-6)18(12)21(26)30-5/h7-11H,1-6H3/b16-11+
InChIKey KRPIEYXZXCLMNT-LFIBNONCSA-N
Molecular Weight 429.425 g/mol
SMILES COC(=O)\C=C/(N1C(C)=C(C(=O)OC)C(C(=O)OC)=C(C)c2ccccc12)C(=O)OC
SPLASH splash10-053r-0900000000-13246b601a53b78068b4
Source of Spectrum Y-27-859-8
Synonyms 1-[(E)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]-2,5-dimethyl-1-benzazepine-3,4-dicarboxylic acid dimethyl ester 1-[(E)-1-carbomethoxy-3-keto-3-methoxy-prop-1-enyl]-2,5-dimethyl-1-benzazepine-3,4-dicarboxylic acid dimethyl ester Dimethyl 1-[(E)-1,4-dimethoxy-1,4-bis(oxidanylidene)but-2-en-2-yl]-2,5-dimethyl-1-benzazepine-3,4-dicarboxylate Dimethyl 1-[(E)-1,4-dimethoxy-1,4-dioxobut-2-en-2-yl]-2,5-dimethyl-1-benzazepine-3,4-dicarboxylate Dimethyl 1-[(E)-3-methoxy-1-methoxycarbonyl-3-oxo-prop-1-enyl]-2,5-dimethyl-1-benzazepine-3,4-dicarboxylate Dimethyl 2'-[2,5-dimethyl-3,4-bis(methoxycarbonyl)-6,7-benzo(1H)azepin-1-yl]maleate
Wiley ID 1381154