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2-methyl-5-(trifluoromethyl)benzothiazole

View entire compound with spectra: 3 NMR, 1 FTIR, and 2 MS (GC)

2-methyl-5-(trifluoromethyl)benzothiazole
SpectraBase Compound ID WA88tszReo
InChI InChI=1S/C9H6F3NS/c1-5-13-7-4-6(9(10,11)12)2-3-8(7)14-5/h2-4H,1H3
InChIKey XXIOZBPOLWETSU-UHFFFAOYSA-N
Mol Weight 217.21 g/mol
Molecular Formula C9H6F3NS
Exact Mass 217.017305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVt4ncq5Pm9
Name Benzothiazole, 2-methyl-5-(trifluoromethyl)-
CAS Registry Number 398-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6F3NS
InChI InChI=1S/C9H6F3NS/c1-5-13-7-4-6(9(10,11)12)2-3-8(7)14-5/h2-4H,1H3
InChIKey XXIOZBPOLWETSU-UHFFFAOYSA-N
Molecular Weight 217.209 g/mol
SMILES Cc1sc2c(n1)cc(C(F)(F)F)cc2
SPLASH splash10-014i-6960000000-452904a2aaa73ba18012
Source of Spectrum W6-0-0-0
Synonyms 2-Methyl-5-(trifluoromethyl)-1,3-benzothiazole 2-Methyl-5-trifluoromethylbenzothiazole EINECS 206-914-8
Wiley ID 95456