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3,3-Dimethyl-2,3,4,5,10,11-hexahydro-11-[(2-nitro)phenyl]-1Hdibenzo[b,e][1,4]diazepin-1-one
SpectraBase Compound ID E63vgOqlQsv
InChI InChI=1S/C21H21N3O3/c1-21(2)11-16-19(18(25)12-21)20(13-7-3-6-10-17(13)24(26)27)23-15-9-5-4-8-14(15)22-16/h3-10,20,22-23H,11-12H2,1-2H3
InChIKey APLUNMQQBTXRAA-UHFFFAOYSA-N
Mol Weight 363.42 g/mol
Molecular Formula C21H21N3O3
Exact Mass 363.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBuap21BDuD
Name 3,3-Dimethyl-2,3,4,5,10,11-hexahydro-11-[(2-nitro)phenyl]-1Hdibenzo[b,e][1,4]diazepin-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O3
InChI InChI=1S/C21H21N3O3/c1-21(2)11-16-19(18(25)12-21)20(13-7-3-6-10-17(13)24(26)27)23-15-9-5-4-8-14(15)22-16/h3-10,20,22-23H,11-12H2,1-2H3
InChIKey APLUNMQQBTXRAA-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C4NJ01893A
Molecular Weight 363.417 g/mol
SMILES N1C(C2=C(Nc3c1cccc3)CC(CC2=O)(C)C)c1c(cccc1)[N+](=O)[O-]
SPLASH splash10-0a4l-9241000000-709ec61c156eaacb0fcf
Source of Spectrum Y2-39-1231-3c
Synonyms 3,3-Dimethyl-11-(2-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Wiley ID 1804587