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1H-1,4-Benzodiazepine, 2,3-dihydro-3-(4-methyl-1-piperazinyl)-7-nitro-5-phenyl-

View entire compound with spectra: 1 MS (GC)

1H-1,4-Benzodiazepine, 2,3-dihydro-3-(4-methyl-1-piperazinyl)-7-nitro-5-phenyl-
SpectraBase Compound ID 8u3C6lbPi6t
InChI InChI=1S/C20H23N5O2/c1-23-9-11-24(12-10-23)19-14-21-18-8-7-16(25(26)27)13-17(18)20(22-19)15-5-3-2-4-6-15/h2-8,13,19,21H,9-12,14H2,1H3
InChIKey JDGDOPWAKYCVLU-UHFFFAOYSA-N
Mol Weight 365.44 g/mol
Molecular Formula C20H23N5O2
Exact Mass 365.185175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLP89I17txD
Name 1H-1,4-Benzodiazepine, 2,3-dihydro-3-(4-methyl-1-piperazinyl)-7-nitro-5-phenyl-
CAS Registry Number 84505-21-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N5O2
InChI InChI=1S/C20H23N5O2/c1-23-9-11-24(12-10-23)19-14-21-18-8-7-16(25(26)27)13-17(18)20(22-19)15-5-3-2-4-6-15/h2-8,13,19,21H,9-12,14H2,1H3
InChIKey JDGDOPWAKYCVLU-UHFFFAOYSA-N
Molecular Weight 365.437 g/mol
SMILES N1c2ccc(cc2C(=NC(C1)N1CCN(CC1)C)c1ccccc1)N(=O)=O
SPLASH splash10-0a4l-9000000000-f6c6e91f7f172d4127c5
Source of Spectrum KO-11-412-8
Synonyms 3-(4-Methyl-1-piperazinyl)-7-nitro-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepine 7-Nitro-5-phenyl-3-(1,4-diaza-4-methyl-cyclohexyl)-1,4-benzodiazepine
Wiley ID 1351395