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(4S)-5-Acetyl-4-(4-nitrophenyl)-4,5-dihydro-1H-[1,5]benzodiazepin-2(3H)-one
SpectraBase Compound ID 38GX4lgBRyd
InChI InChI=1S/C17H15N3O4/c1-11(21)19-15-5-3-2-4-14(15)18-17(22)10-16(19)12-6-8-13(9-7-12)20(23)24/h2-9,16H,10H2,1H3,(H,18,22)/t16-/m0/s1
InChIKey CSJAJMCLCVCFSE-INIZCTEOSA-N
Mol Weight 325.32 g/mol
Molecular Formula C17H15N3O4
Exact Mass 325.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoG5NaGLiWr
Name (4S)-5-Acetyl-4-(4-nitrophenyl)-4,5-dihydro-1H-[1,5]benzodiazepin-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O4
InChI InChI=1S/C17H15N3O4/c1-11(21)19-15-5-3-2-4-14(15)18-17(22)10-16(19)12-6-8-13(9-7-12)20(23)24/h2-9,16H,10H2,1H3,(H,18,22)/t16-/m0/s1
InChIKey CSJAJMCLCVCFSE-INIZCTEOSA-N
Literature Reference DOI 10.1002/adsc.201000547
Molecular Weight 325.324 g/mol
SMILES N1c2ccccc2N([C@@](CC1=O)(c1ccc(cc1)[N+](=O)[O-])[H])C(=O)C
SPLASH splash10-015c-2920000000-599cb532a964565966bf
Source of Spectrum ASC-352-2633-5b
Synonyms (S)-5-acetyl-4-(4-nitrophenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one
Wiley ID 1764011