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8-Ethynyl-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
SpectraBase Compound ID 3yDntnvVLVH
InChI InChI=1S/C17H15N3O3/c1-4-11-6-7-13-12(8-11)16(21)19(3)9-14-15(17(22)23-5-2)18-10-20(13)14/h1,6-8,10H,5,9H2,2-3H3
InChIKey WDTNKNNGHGOKBH-UHFFFAOYSA-N
Mol Weight 309.33 g/mol
Molecular Formula C17H15N3O3
Exact Mass 309.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HElHfDe905o
Name 8-Ethynyl-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O3
InChI InChI=1S/C17H15N3O3/c1-4-11-6-7-13-12(8-11)16(21)19(3)9-14-15(17(22)23-5-2)18-10-20(13)14/h1,6-8,10H,5,9H2,2-3H3
InChIKey WDTNKNNGHGOKBH-UHFFFAOYSA-N
Molecular Weight 309.325 g/mol
SMILES c12[n](-c3c(C(N(C2)C)=O)cc(cc3)C#C)cnc1C(=O)OCC
SPLASH splash10-01p9-0191000000-c3c1144478a5b7fba54b
Source of Spectrum E1-39-1933-6
Synonyms 8-Ethynyl-6-keto-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid ethyl ester Ethyl 8-ethynyl-5-methyl-6-oxidanylidene-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Ethyl 8-ethynyl-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Wiley ID 1598835