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benzoxazole, 5,7-dichloro-2-[[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]thio]-
SpectraBase Compound ID 4XG2SQny7sJ
InChI InChI=1S/C16H9Cl2F4NO2S/c17-9-5-11(18)13-12(6-9)23-15(24-13)26-7-8-1-3-10(4-2-8)25-16(21,22)14(19)20/h1-6,14H,7H2
InChIKey AEJASHFOWFCCIV-UHFFFAOYSA-N
Mol Weight 426.21 g/mol
Molecular Formula C16H9Cl2F4NO2S
Exact Mass 424.966718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfKNFt9qAJs
Name 5,7-bis(chloranyl)-2-[[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenyl]methylsulfanyl]-1,3-benzoxazole
Alternate Name(s) 5,7-Dichloro-2-[[4-(1,1,2,2-tetrafluoroethoxy)benzyl]thio]-1,3-benzoxazole 5,7-Dichloro-2-[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methylsulfanyl]-1,3-benzoxazole 5,7-Dichloro-2-[[4-(1,1,2,2-tetrafluoroethoxy)phenyl]methylthio]-1,3-benzoxazole 5,7-Dichloro-2-{[4-(1,1,2,2-tetrafluoroethoxy)benzyl]sulfanyl}-1,3-benzoxazole
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Formula C16H9Cl2F4NO2S
InChI InChI=1S/C16H9Cl2F4NO2S/c17-9-5-11(18)13-12(6-9)23-15(24-13)26-7-8-1-3-10(4-2-8)25-16(21,22)14(19)20/h1-6,14H,7H2
InChIKey AEJASHFOWFCCIV-UHFFFAOYSA-N
Molecular Weight 426.213 g/mol
SMILES c1cc(OC(C(F)F)(F)F)ccc1CSc1nc2c(c(Cl)cc(c2)Cl)o1
SPLASH splash10-0a4i-1290000000-9c000681445fea433e4b
Wiley ID 1462019