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2-(4-Chloroanilino)-3-(trifluoromethyl)-1,4-naphthoquinone
SpectraBase Compound ID HWQAG7AuqkW
InChI InChI=1S/C17H9ClF3NO2/c18-9-5-7-10(8-6-9)22-14-13(17(19,20)21)15(23)11-3-1-2-4-12(11)16(14)24/h1-8,22H
InChIKey YKZXOUDIXUQWAN-UHFFFAOYSA-N
Mol Weight 351.71 g/mol
Molecular Formula C17H9ClF3NO2
Exact Mass 351.027391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A73aYEXg6O7
Name 2-(4-Chloroanilino)-3-(trifluoromethyl)-1,4-naphthoquinone
Alternate Name(s) 2-(4-Chloroanilino)-3-(trifluoromethyl)naphthoquinone 2-(4-Chloroanilino)-3-(trifluoropropyl)-1,4-naphthoquinone
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Formula C17H9ClF3NO2
InChI InChI=1S/C17H9ClF3NO2/c18-9-5-7-10(8-6-9)22-14-13(17(19,20)21)15(23)11-3-1-2-4-12(11)16(14)24/h1-8,22H
InChIKey YKZXOUDIXUQWAN-UHFFFAOYSA-N
Molecular Weight 351.712 g/mol
SMILES N(C1=C(C(c2c(cccc2)C1=O)=O)C(F)(F)F)c1ccc(cc1)Cl
SPLASH splash10-0ue9-0089000000-f2160715b5d4c5f7a917
Source of Spectrum AJ-68-1048-8
Wiley ID 773158