benzoic acid, 4-[[[[1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl]thio]acetyl]amino]-

SpectraBase Compound ID	5r6E8Q4CDJS
InChI	InChI=1S/C17H12F3N5O3S/c18-17(19,20)11-2-1-3-13(8-11)25-16(22-23-24-25)29-9-14(26)21-12-6-4-10(5-7-12)15(27)28/h1-8H,9H2,(H,21,26)(H,27,28)
InChIKey	FYLVOASFMBPYRI-UHFFFAOYSA-N Google Search
Mol Weight	423.37 g/mol
Molecular Formula	C17H12F3N5O3S
Exact Mass	423.061295 g/mol

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SpectraBase Spectrum ID	7KHHwIY7MZP
Name	benzoic acid, 4-[[[[1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl]thio]acetyl]amino]-
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/C17H12F3N5O3S/c18-17(19,20)11-2-1-3-13(8-11)25-16(22-23-24-25)29-9-14(26)21-12-6-4-10(5-7-12)15(27)28/h1-8H,9H2,(H,21,26)(H,27,28)
InChIKey	FYLVOASFMBPYRI-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_7392
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: F30519; Labnumber: ExMat1-34603