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1H-1,4-Diazepino[2,1-a]isoquinoline-5-carboxylic acid, 2,3,7,8-tetrahydro-3-oxo-, ethyl ester
SpectraBase Compound ID LN99At6tZ3H
InChI InChI=1S/C16H18N2O3/c1-2-21-16(20)13-9-15(19)17-10-14-12-6-4-3-5-11(12)7-8-18(13)14/h3-6,9,14H,2,7-8,10H2,1H3,(H,17,19)
InChIKey UJCCAFWXHZPCJC-UHFFFAOYSA-N
Mol Weight 286.33 g/mol
Molecular Formula C16H18N2O3
Exact Mass 286.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIgnaDyIcXK
Name 1H-1,4-Diazepino[2,1-a]isoquinoline-5-carboxylic acid, 2,3,7,8-tetrahydro-3-oxo-, ethyl ester
Alternate Name(s) 3-keto-2,7,8,12b-tetrahydro-1H-[1,4]diazepin[2,1-a]isoquinoline-5-carboxylic acid ethyl ester 3-Oxo-2,7,8,12b-tetrahydro-1H-[1,4]diazepino[2,1-a]isoquinoline-5-carboxylic acid ethyl ester Ethyl 3-oxidanylidene-2,7,8,12b-tetrahydro-1H-[1,4]diazepino[2,1-a]isoquinoline-5-carboxylate Ethyl 3-oxo-1,2,3,7,8,12b-hexahydro[1,4]diazepino[2,1-a]isoquinoline-5-carboxylate Ethyl 3-oxo-2,7,8,12b-tetrahydro-1H-[1,4]diazepino[2,1-a]isoquinoline-5-carboxylate
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Formula C16H18N2O3
InChI InChI=1S/C16H18N2O3/c1-2-21-16(20)13-9-15(19)17-10-14-12-6-4-3-5-11(12)7-8-18(13)14/h3-6,9,14H,2,7-8,10H2,1H3,(H,17,19)
InChIKey UJCCAFWXHZPCJC-UHFFFAOYSA-N
Molecular Weight 286.331 g/mol
SMILES N1C(C=C(N2C(C1)c1ccccc1CC2)C(=O)OCC)=O
SPLASH splash10-001i-2930000000-ab0335f1f642ae030894
Source of Spectrum AD-0-2532-0
Wiley ID 1430970