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2-(4-Methylphenyl)-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepine

View entire compound with spectra: 1 NMR, and 2 MS (GC)

2-(4-Methylphenyl)-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
SpectraBase Compound ID BAkwLgUZrVa
InChI InChI=1S/C22H20N2/c1-16-11-13-18(14-12-16)22-15-21(17-7-3-2-4-8-17)23-19-9-5-6-10-20(19)24-22/h2-14,22,24H,15H2,1H3
InChIKey MQURZQLYCKLJES-UHFFFAOYSA-N
Mol Weight 312.42 g/mol
Molecular Formula C22H20N2
Exact Mass 312.162649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KLwfd8ihYx9
Name 2-(4-Methylphenyl)-4-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
Comments Computed using HOSE algorithm
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Exact Mass 312.162648652 u
Formula C22H20N2
InChI InChI=1S/C22H20N2/c1-16-11-13-18(14-12-16)22-15-21(17-7-3-2-4-8-17)23-19-9-5-6-10-20(19)24-22/h2-14,22,24H,15H2,1H3
InChIKey MQURZQLYCKLJES-UHFFFAOYSA-N
Molecular Weight 312.416 g/mol
SMILES C1(=NC=2C(NC(C1)C=1C=CC(=CC1)C)=CC=CC2)C=1C=CC=CC1