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2-Methyl-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
SpectraBase Compound ID GU9XTrCCi2O
InChI InChI=1S/C16H18N2/c1-12-11-16(13-7-3-2-4-8-13)18-15-10-6-5-9-14(15)17-12/h2-10,12,16-18H,11H2,1H3
InChIKey AACUOXBEBGHUDN-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C16H18N2
Exact Mass 238.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiSOEpHqkXW
Name 2-Methyl-4-phenyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
Alternate Name(s) cis-2,3,4,5-Tetrahydro-2-methyl-4-phenyl(1H)-1,5-benzodiazepine
CAS Registry Number 111536-76-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2
InChI InChI=1S/C16H18N2/c1-12-11-16(13-7-3-2-4-8-13)18-15-10-6-5-9-14(15)17-12/h2-10,12,16-18H,11H2,1H3
InChIKey AACUOXBEBGHUDN-UHFFFAOYSA-N
Molecular Weight 238.334 g/mol
SMILES N1c2c(NC(CC1c1ccccc1)C)cccc2
SPLASH splash10-00kr-2980000000-b85f73bc6344b7f15e6e
Source of Spectrum O-22-663-7
Wiley ID 1241431