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4-Methyl-5-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one
SpectraBase Compound ID KIwIbOluT1w
InChI InChI=1S/C19H17N3O4/c1-13-12-18(23)20-16-4-2-3-5-17(16)21(13)19(24)11-8-14-6-9-15(10-7-14)22(25)26/h2-11,13H,12H2,1H3,(H,20,23)/b11-8+
InChIKey UAKZJTLZQSDSON-DHZHZOJOSA-N
Mol Weight 351.36 g/mol
Molecular Formula C19H17N3O4
Exact Mass 351.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tz6VmvZCc8
Name 4-Methyl-5-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3O4
InChI InChI=1S/C19H17N3O4/c1-13-12-18(23)20-16-4-2-3-5-17(16)21(13)19(24)11-8-14-6-9-15(10-7-14)22(25)26/h2-11,13H,12H2,1H3,(H,20,23)/b11-8+
InChIKey UAKZJTLZQSDSON-DHZHZOJOSA-N
Literature Reference DOI 10.1002_1521-4184(200101)334_1_11
Molecular Weight 351.362 g/mol
SMILES N1C(CC(N(c2c1cccc2)C(=O)\C=C\c1ccc(cc1)[N+](=O)[O-])C)=O
SPLASH splash10-004i-0902000000-ea855d6193e41ee186d0
Source of Spectrum APP-334-15-3
Synonyms 5-(4-Nitrocinnamoyl)-4-methyl-1H-2,3,4,5-tetrahydro-1,5-benzodiazepin-2-one 4-Methyl-5-[(E)-3-(4-nitrophenyl)acryloyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one 4-Methyl-5-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one (E)-4-methyl-5-(3-(4-nitrophenyl)acryloyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one
Wiley ID 1770475