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1H-1,2,4-triazole, 1-(2-bromobenzoyl)-3-[(phenylmethyl)thio]-
SpectraBase Compound ID rYUjtaaANy
InChI InChI=1S/C16H12BrN3OS/c17-14-9-5-4-8-13(14)15(21)20-11-18-16(19-20)22-10-12-6-2-1-3-7-12/h1-9,11H,10H2
InChIKey CDEJAWMNMRPVQF-UHFFFAOYSA-N
Mol Weight 374.26 g/mol
Molecular Formula C16H12BrN3OS
Exact Mass 372.988446 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1nzCONsfUz2
Name 1H-1,2,4-triazole, 1-(2-bromobenzoyl)-3-[(phenylmethyl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.988446191 u
Formula C16H12BrN3OS
InChI InChI=1S/C16H12BrN3OS/c17-14-9-5-4-8-13(14)15(21)20-11-18-16(19-20)22-10-12-6-2-1-3-7-12/h1-9,11H,10H2
InChIKey CDEJAWMNMRPVQF-UHFFFAOYSA-N
Molecular Weight 374.256 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8584
Solvent DMSO-d6
Source Vendor ID: NMR/10210248; Lab Info: LP; Lab Number: LP-3701140