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3-Methyl-5-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one
SpectraBase Compound ID GTklOsup9iF
InChI InChI=1S/C19H17N3O4/c1-13-12-21(17-5-3-2-4-16(17)20-19(13)24)18(23)11-8-14-6-9-15(10-7-14)22(25)26/h2-11,13H,12H2,1H3,(H,20,24)/b11-8+
InChIKey SLLNGEGNGSRGNR-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 K8Q651ztrW7
Name 3-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/c1-13-12-21(17-5-3-2-4-16(17)20-19(13)24)18(23)11-8-14-6-9-15(10-7-14)22(25)26/h2-11,13H,12H2,1H3,(H,20,24)/b11-8+
InChIKey SLLNGEGNGSRGNR-DHZHZOJOSA-N
Literature Reference DOI 10.1002_1521-4184(200101)334_1_11
Molecular Weight 351.362 g/mol
SMILES N1C(C(CN(c2c1cccc2)C(=O)\C=C\c1ccc(cc1)[N+](=O)[O-])C)=O
SPLASH splash10-0v29-1902000000-3ec70486ea935823dc0b
Source of Spectrum APP-334-15-6
Synonyms 5-(4-Nitrocinnamoyl)-3-methyl-1H-2,3,4,5-tetrahydro-1,5-benzodiazepin-2-one 3-Methyl-5-[(E)-3-(4-nitrophenyl)acryloyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one 3-Methyl-5-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one (E)-3-methyl-5-(3-(4-nitrophenyl)acryloyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one
Wiley ID 1770478