ethanone, 1-(4-bromophenyl)-2-[[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-

SpectraBase Compound ID	NC9KEOnfIz
InChI	InChI=1S/C23H17BrFN3OS/c1-15-4-2-3-5-20(15)28-22(17-8-12-19(25)13-9-17)26-27-23(28)30-14-21(29)16-6-10-18(24)11-7-16/h2-13H,14H2,1H3
InChIKey	PHKMDWHEEJSPJN-UHFFFAOYSA-N Google Search
Mol Weight	482.37 g/mol
Molecular Formula	C23H17BrFN3OS
Exact Mass	481.025975 g/mol

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SpectraBase Spectrum ID	6WQ0QhsDUr6
Name	ethanone, 1-(4-bromophenyl)-2-[[5-(4-fluorophenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-
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/C23H17BrFN3OS/c1-15-4-2-3-5-20(15)28-22(17-8-12-19(25)13-9-17)26-27-23(28)30-14-21(29)16-6-10-18(24)11-7-16/h2-13H,14H2,1H3
InChIKey	PHKMDWHEEJSPJN-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_6854
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: NMR/10321046; Labnumber: DEM-0000159