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6-Methyl-8-(3,3,4,4,5,5,6,6,6-nonafluorohexylsulfanylmethyl)1,3-benzoxathian
SpectraBase Compound ID 4gzyU49WIaw
InChI InChI=1S/C16H15F9OS2/c1-9-4-10(12-11(5-9)7-28-8-26-12)6-27-3-2-13(17,18)14(19,20)15(21,22)16(23,24)25/h4-5H,2-3,6-8H2,1H3
InChIKey DAMMRHZBIMIUDD-UHFFFAOYSA-N
Mol Weight 458.4 g/mol
Molecular Formula C16H15F9OS2
Exact Mass 458.042061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jyv3o9zhCpx
Name 6-Methyl-8-(3,3,4,4,5,5,6,6,6-nonafluorohexylsulfanylmethyl)1,3-benzoxathian
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Formula C16H15F9OS2
InChI InChI=1S/C16H15F9OS2/c1-9-4-10(12-11(5-9)7-28-8-26-12)6-27-3-2-13(17,18)14(19,20)15(21,22)16(23,24)25/h4-5H,2-3,6-8H2,1H3
InChIKey DAMMRHZBIMIUDD-UHFFFAOYSA-N
Molecular Weight 458.401 g/mol
SMILES C(C(C(CCSCc1c2c(CSCO2)cc(c1)C)(F)F)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-057i-0900100000-5d91786f2f4b8b97735a
Source of Spectrum F4-41-3850-3d
Synonyms 6-Methyl-8-(3,3,4,4,5,5,6,6,6-nonafluorohexylsulfanylmethyl)-4H-1,3-benzoxathiine 6-Methyl-8-[3,3,4,4,5,5,6,6,6-nonakis(fluoranyl)hexylsulfanylmethyl]-4H-1,3-benzoxathiine
Wiley ID 1673161