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2-Methyl-2,4-bis(4-fluorophenyl)-2,3-dihydro-7,8-dichloro-1H-1,5-benzodiazepine
SpectraBase Compound ID FtK5rmlEaW
InChI InChI=1S/C22H16Cl2F2N2/c1-22(14-4-8-16(26)9-5-14)12-21(13-2-6-15(25)7-3-13)27-19-10-17(23)18(24)11-20(19)28-22/h2-11,28H,12H2,1H3
InChIKey NWEQJPISRHZVHJ-UHFFFAOYSA-N
Mol Weight 417.29 g/mol
Molecular Formula C22H16Cl2F2N2
Exact Mass 416.06586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lt2eKkrP1C
Name 2-Methyl-2,4-bis(4-fluorophenyl)-2,3-dihydro-7,8-dichloro-1H-1,5-benzodiazepine
Alternate Name(s) 7,8-Dichloro-2,4-bis(4-fluorophenyl)-2-methyl-2,3-dihydro-1H-benzo[b][1,4]diazepine 7,8-Bis(chloranyl)-2,4-bis(4-fluorophenyl)-2-methyl-1,3-dihydro-1,5-benzodiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16Cl2F2N2
InChI InChI=1S/C22H16Cl2F2N2/c1-22(14-4-8-16(26)9-5-14)12-21(13-2-6-15(25)7-3-13)27-19-10-17(23)18(24)11-20(19)28-22/h2-11,28H,12H2,1H3
InChIKey NWEQJPISRHZVHJ-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo300543n
Molecular Weight 417.287 g/mol
SMILES N1C(CC(=Nc2cc(c(cc12)Cl)Cl)c1ccc(cc1)F)(c1ccc(cc1)F)C
SPLASH splash10-0gc0-0060900000-8baaebea72112c3e400f
Source of Spectrum J-77-4489-3u
Wiley ID 1746979