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trans-1-(4-Chlorophenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine
SpectraBase Compound ID BzNHq8LVuCg
InChI InChI=1S/C24H21ClN2/c1-24(19-8-3-2-4-9-19)22(18-11-13-20(25)14-12-18)27-16-15-17-7-5-6-10-21(17)26-23(24)27/h2-14,22H,15-16H2,1H3/t22-,24-/m0/s1
InChIKey RRJWIQBGWJSSIP-UPVQGACJSA-N
Mol Weight 372.9 g/mol
Molecular Formula C24H21ClN2
Exact Mass 372.139326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3czfPgeTpuL
Name trans-1-(4-Chlorophenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine
Comments Less than 3 mono-isotopic peaks
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Formula C24H21ClN2
InChI InChI=1S/C24H21ClN2/c1-24(19-8-3-2-4-9-19)22(18-11-13-20(25)14-12-18)27-16-15-17-7-5-6-10-21(17)26-23(24)27/h2-14,22H,15-16H2,1H3/t22-,24-/m0/s1
InChIKey RRJWIQBGWJSSIP-UPVQGACJSA-N
Molecular Weight 372.899 g/mol
SMILES C1=2[C@](c3ccccc3)(C)[C@@](N1CCc1c(N2)cccc1)(c1ccc(cc1)Cl)[H]
SPLASH splash10-001i-0903000000-537f44c39e408a9be612
Source of Spectrum QE-5-1116-10
Synonyms (1S,2S)-1-(4-Chloro-phenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydro-3,9a-diaza-benzo[a]cyclobuta[d]cycloheptene (1S,2S)-1-(4-chlorophenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine
Wiley ID 844084