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2-Benzothiazolethiol, 5-(trifluoromethyl)-
SpectraBase Compound ID MCatuRwfYG
InChI InChI=1S/C8H4F3NS2/c9-8(10,11)4-1-2-6-5(3-4)12-7(13)14-6/h1-3H,(H,12,13)
InChIKey DJRUWESABPZMRB-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C8H4F3NS2
Exact Mass 234.973726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2s3oC6bbUPO
Name 5-(Trifluoromethyl)-1,3-benzothiazole-2-thiol
CAS Registry Number 23420-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4F3NS2
InChI InChI=1S/C8H4F3NS2/c9-8(10,11)4-1-2-6-5(3-4)12-7(13)14-6/h1-3H,(H,12,13)
InChIKey DJRUWESABPZMRB-UHFFFAOYSA-N
Molecular Weight 235.242 g/mol
SMILES Sc1nc2c(ccc(C(F)(F)F)c2)s1
SPLASH splash10-000i-3590000000-d2b0967f015ff48d40c8
Source of Spectrum AD-0-2532-0
Synonyms 2(3H)-Benzothiazole-2-thione, 5-trifluoromethyl- 5-(trifluoromethyl)-3H-1,3-benzothiazole-2-thione Benzothiazole-2-thiol, 5-trifluoromethyl-
Wiley ID 1431273