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(1S,2R)-1-(4-Methylphenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine

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(1S,2R)-1-(4-Methylphenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine
SpectraBase Compound ID HaabLAmcsKA
InChI InChI=1S/C25H24N2/c1-18-12-14-20(15-13-18)23-25(2,21-9-4-3-5-10-21)24-26-22-11-7-6-8-19(22)16-17-27(23)24/h3-15,23H,16-17H2,1-2H3/t23-,25+/m0/s1
InChIKey NELYVDSJZXMCMU-UKILVPOCSA-N
Mol Weight 352.48 g/mol
Molecular Formula C25H24N2
Exact Mass 352.193949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbGt0Xp7lB0
Name (1S,2R)-1-(4-Methylphenyl)-2-methyl-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine
Alternate Name(s) (1S,2R)-2-methyl-1-(4-methylphenyl)-2-phenyl-1,2,8,9-tetrahydroazeto[2,1-b][1,3]benzodiazepine cis-1-(4-Methylphenyl)-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 C25H24N2
InChI InChI=1S/C25H24N2/c1-18-12-14-20(15-13-18)23-25(2,21-9-4-3-5-10-21)24-26-22-11-7-6-8-19(22)16-17-27(23)24/h3-15,23H,16-17H2,1-2H3/t23-,25+/m0/s1
InChIKey NELYVDSJZXMCMU-UKILVPOCSA-N
Molecular Weight 352.481 g/mol
SMILES C1=2[C@@](c3ccccc3)(C)[C@@](N1CCc1c(N2)cccc1)(c1ccc(cc1)C)[H]
SPLASH splash10-0ue9-0409000000-448b979e2734a92e7025
Source of Spectrum QE-5-1116-10
Wiley ID 844081