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2-(4-Anisidino)-3-(perfluoropropyl)-1,4-naphthoquinone
SpectraBase Compound ID ACONJymVDMi
InChI InChI=1S/C20H12F7NO3/c1-31-11-8-6-10(7-9-11)28-15-14(18(21,22)19(23,24)20(25,26)27)16(29)12-4-2-3-5-13(12)17(15)30/h2-9,28H,1H3
InChIKey VMIIBGWHTNFLGM-UHFFFAOYSA-N
Mol Weight 447.31 g/mol
Molecular Formula C20H12F7NO3
Exact Mass 447.07054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbeeC1eMTdP
Name 2-(4-Anisidino)-3-(perfluoropropyl)-1,4-naphthoquinone
Alternate Name(s) 2-(1,1,2,2,3,3,3-heptafluoropropyl)-3-(4-methoxyanilino)naphthoquinone 2-(4-Anisidino)-3-(perluoropropyl)-1,4-naphthoquinone
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Formula C20H12F7NO3
InChI InChI=1S/C20H12F7NO3/c1-31-11-8-6-10(7-9-11)28-15-14(18(21,22)19(23,24)20(25,26)27)16(29)12-4-2-3-5-13(12)17(15)30/h2-9,28H,1H3
InChIKey VMIIBGWHTNFLGM-UHFFFAOYSA-N
Molecular Weight 447.309 g/mol
SMILES N(C1=C(C(C(C(F)(F)F)(F)F)(F)F)C(c2c(cccc2)C1=O)=O)c1ccc(cc1)OC
SPLASH splash10-0a4j-0009800000-72f1a7068b8b7bb8a3ff
Source of Spectrum AJ-68-1048-8
Wiley ID 773160