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11H-benzo[b][1,4]benzodiazepin-6-yl-(2-chlorophenyl)-methyl-amine

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

11H-benzo[b][1,4]benzodiazepin-6-yl-(2-chlorophenyl)-methyl-amine
SpectraBase Compound ID DF9r98Rvx8E
InChI InChI=1S/C20H16ClN3/c1-24(19-13-7-3-9-15(19)21)20-14-8-2-4-10-16(14)22-17-11-5-6-12-18(17)23-20/h2-13,22H,1H3
InChIKey ZBMNADYWNKANCO-UHFFFAOYSA-N
Mol Weight 333.82 g/mol
Molecular Formula C20H16ClN3
Exact Mass 333.103275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0ef8yYnR11
Name 11H-Benzo[B][1,4]benzodiazepin-6-yl-(2-chlorophenyl)-methyl-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.103275227 u
Formula C20H16ClN3
InChI InChI=1S/C20H16ClN3/c1-24(19-13-7-3-9-15(19)21)20-14-8-2-4-10-16(14)22-17-11-5-6-12-18(17)23-20/h2-13,22H,1H3
InChIKey ZBMNADYWNKANCO-UHFFFAOYSA-N
Molecular Weight 333.822 g/mol
SMILES C1(=NC2=C(C=CC=C2)NC2=C1C=CC=C2)N(C1=C(Cl)C=CC=C1)C