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N,N'-DI-[3,5-DI-(TRIFLUOROMETHYL)-PHENYL]-THIOUREA
SpectraBase Compound ID D82hW2iOBxg
InChI InChI=1S/C17H8F12N2S/c18-14(19,20)7-1-8(15(21,22)23)4-11(3-7)30-13(32)31-12-5-9(16(24,25)26)2-10(6-12)17(27,28)29/h1-6H,(H2,30,31,32)
InChIKey RWXWQJYJWJNJNW-UHFFFAOYSA-N
Mol Weight 500.31 g/mol
Molecular Formula C17H8F12N2S
Exact Mass 500.021657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B29AQ8svhoW
Name N,N'-Bis[3,5-bis(trifluoromethyl)phenyl]thiourea
Alternate Name(s) 1,3-bis[3,5-bis(trifluoromethyl)phenyl]thiourea Carbanilide, thio-3,3',5,5'-tetrakis-(trifluoromethyl)- Thiourea, 1,3-bis(3,5-ditrifluoromethylphenyl)-
CAS Registry Number 1060-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H8F12N2S
InChI InChI=1S/C17H8F12N2S/c18-14(19,20)7-1-8(15(21,22)23)4-11(3-7)30-13(32)31-12-5-9(16(24,25)26)2-10(6-12)17(27,28)29/h1-6H,(H2,30,31,32)
InChIKey RWXWQJYJWJNJNW-UHFFFAOYSA-N
Molecular Weight 500.306 g/mol
SMILES N(C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)=S)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
SPLASH splash10-02k9-5690200000-028979d5eef75448658a
Source of Spectrum AD-0-2532-0
Wiley ID 1429035