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4-(3-(4-bromophenyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide
SpectraBase Compound ID ELkI2KH9mbh
InChI InChI=1S/C16H11BrF3N3O2S/c17-11-3-1-10(2-4-11)14-9-15(16(18,19)20)23(22-14)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
InChIKey LLIRLFAYAZJFPD-UHFFFAOYSA-N
Mol Weight 446.24 g/mol
Molecular Formula C16H11BrF3N3O2S
Exact Mass 444.970745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRLpyY1LJlQ
Name 4-(3-(4-Bromophenyl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11BrF3N3O2S
InChI InChI=1S/C16H11BrF3N3O2S/c17-11-3-1-10(2-4-11)14-9-15(16(18,19)20)23(22-14)12-5-7-13(8-6-12)26(21,24)25/h1-9H,(H2,21,24,25)
InChIKey LLIRLFAYAZJFPD-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.ejmech.2015.07.036
Molecular Weight 446.242 g/mol
SMILES NS(c1ccc(-[n]2nc(-c3ccc(cc3)Br)cc2C(F)(F)F)cc1)(=O)=O
SPLASH splash10-0005-0010900000-21b5065063498bac1296
Source of Spectrum EMC-102-149-4f
Wiley ID 1801151