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[2-Thioxo-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-4-yl]-acetonitrile
SpectraBase Compound ID AumcWd5rOTD
InChI InChI=1S/C12H7F3N2S2/c13-12(14,15)8-2-1-3-9(6-8)17-10(4-5-16)7-19-11(17)18/h1-3,6-7H,4H2
InChIKey RQOLOUNQALWSKF-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C12H7F3N2S2
Exact Mass 300.000275 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWMV7X4B0NI
Name [2-Thioxo-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-4-yl]-acetonitrile
Alternate Name(s) 2-(2-Thioxo-3-(3-(trifluoromethyl)phenyl)-2,3-dihydrothiazol-4-yl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F3N2S2
InChI InChI=1S/C12H7F3N2S2/c13-12(14,15)8-2-1-3-9(6-8)17-10(4-5-16)7-19-11(17)18/h1-3,6-7H,4H2
InChIKey RQOLOUNQALWSKF-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200004)342_4_355
Molecular Weight 300.317 g/mol
SMILES c1(cccc(c1)C(F)(F)F)N1C(SC=C1CC#N)=S
SPLASH splash10-0f6t-2279000000-8bdc57a2ba9930b6188e
Source of Spectrum JF-342-367-11b
Wiley ID 1766931