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1H-1,5-benzodiazepine-1-carboxaldehyde, 5-[(2-chloro-6-fluorophenyl)methyl]-2,3,4,5-tetrahydro-3-methyl-4-oxo-
SpectraBase Compound ID j5VbSCh68S
InChI InChI=1S/C18H16ClFN2O2/c1-12-9-21(11-23)16-7-2-3-8-17(16)22(18(12)24)10-13-14(19)5-4-6-15(13)20/h2-8,11-12H,9-10H2,1H3
InChIKey CXORLZXVYQYZEE-UHFFFAOYSA-N
Mol Weight 346.79 g/mol
Molecular Formula C18H16ClFN2O2
Exact Mass 346.088434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6YLdaYcq98I
Name 1H-1,5-benzodiazepine-1-carboxaldehyde, 5-[(2-chloro-6-fluorophenyl)methyl]-2,3,4,5-tetrahydro-3-methyl-4-oxo-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H16ClFN2O2/c1-12-9-21(11-23)16-7-2-3-8-17(16)22(18(12)24)10-13-14(19)5-4-6-15(13)20/h2-8,11-12H,9-10H2,1H3
InChIKey CXORLZXVYQYZEE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5492
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F25806; Labnumber: ExBayev-19731