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2-Phenyl-5-(4-trifluoromethylphenyl)-1,2-thiazolium perchlorate
SpectraBase Compound ID IYVScOX0lsf
InChI InChI=1S/C16H11F3NS.ClHO4/c17-16(18,19)13-8-6-12(7-9-13)15-10-11-20(21-15)14-4-2-1-3-5-14;2-1(3,4)5/h1-11H;(H,2,3,4,5)/q+1;/p-1
InChIKey XSXOQVDBGDEBSU-UHFFFAOYSA-M
Mol Weight 405.78 g/mol
Molecular Formula C16H11ClF3NO4S
Exact Mass 405.004941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LC3keZGmX8h
Name 2-Phenyl-5-(4-trifluoromethylphenyl)-1,2-thiazolium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClF3NO4S
InChI InChI=1S/C16H11F3NS.ClHO4/c17-16(18,19)13-8-6-12(7-9-13)15-10-11-20(21-15)14-4-2-1-3-5-14;2-1(3,4)5/h1-11H;(H,2,3,4,5)/q+1;/p-1
InChIKey XSXOQVDBGDEBSU-UHFFFAOYSA-M
Molecular Weight 405.775 g/mol
SMILES [Cl]([O-])(=O)(=O)=O.c1(s[n+](cc1)-c1ccccc1)-c1ccc(C(F)(F)F)cc1
SPLASH splash10-004j-9831000000-7c1987a04a4fd05a3b50
Source of Spectrum O1-30-1457-9
Synonyms 2-Phenyl-5-[4-(trifluoromethyl)phenyl]isothiazol-2-ium perchlorate
Wiley ID 818754