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2-[4-(3-bromo-phenyl)-3H-benzo[b][1,4]diazepin-2-yl]-5-methyl-phenol
SpectraBase Compound ID EOR5x7Uqwvk
InChI InChI=1S/C22H17BrN2O/c1-14-9-10-17(22(26)11-14)21-13-20(15-5-4-6-16(23)12-15)24-18-7-2-3-8-19(18)25-21/h2-12,26H,13H2,1H3
InChIKey DBRKPSDVLJGKCK-UHFFFAOYSA-N
Mol Weight 405.3 g/mol
Molecular Formula C22H17BrN2O
Exact Mass 404.052426 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JBxNa4J4Qqg
Name phenol, 2-[4-(3-bromophenyl)-3H-1,5-benzodiazepin-2-yl]-5-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.052426174 u
Formula C22H17BrN2O
InChI InChI=1S/C22H17BrN2O/c1-14-9-10-17(22(26)11-14)21-13-20(15-5-4-6-16(23)12-15)24-18-7-2-3-8-19(18)25-21/h2-12,26H,13H2,1H3
InChIKey DBRKPSDVLJGKCK-UHFFFAOYSA-N
Molecular Weight 405.295 g/mol
NMR Offset 17.0814
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12163
Solvent CDCl3
Source Vendor ID: NMR/10241795; Lab Info: GOR; Lab Number: GOR-0000001