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1H-1,2-Benzodiazepine-5-carboxylic acid, 2,3,6,7,8,9-hexahydro-1,2-dimethyl-3,6-dioxo-, methyl ester
SpectraBase Compound ID 3Tknt7N6bgm
InChI InChI=1S/C13H16N2O4/c1-14-9-5-4-6-10(16)12(9)8(13(18)19-3)7-11(17)15(14)2/h7H,4-6H2,1-3H3
InChIKey CVUVCQQOSPJVRO-UHFFFAOYSA-N
Mol Weight 264.28 g/mol
Molecular Formula C13H16N2O4
Exact Mass 264.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtZG6xOkc53
Name 1H-1,2-Benzodiazepine-5-carboxylic acid, 2,3,6,7,8,9-hexahydro-1,2-dimethyl-3,6-dioxo-, methyl ester
CAS Registry Number 71907-40-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4
InChI InChI=1S/C13H16N2O4/c1-14-9-5-4-6-10(16)12(9)8(13(18)19-3)7-11(17)15(14)2/h7H,4-6H2,1-3H3
InChIKey CVUVCQQOSPJVRO-UHFFFAOYSA-N
Molecular Weight 264.281 g/mol
SMILES C1=2C(=CC(=O)N(N(C2CCCC1=O)C)C)C(=O)OC
SPLASH splash10-08fr-0290000000-49622ecc846bd67b1954
Source of Spectrum K-112-3240-0
Synonyms Methyl 1,2-dimethyl-3,6-dioxo-2,3,6,7,8,9-hexahydro-1H-1,2-benzodiazepine-5-carboxylate Methyl ester of 1,2-dimethyl-3,6-dioxo-2,3,6,7,8,9-hexahydro-1H-1,2-benzodiazepin-5-carboxylic acid
Wiley ID 1267681