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pentafluoro(2-((2-methylallyl)oxy)-2-phenylpropyl)-lamda-6-sulfane
SpectraBase Compound ID EbytkyDzUlV
InChI InChI=1S/C13H17F5OS/c1-11(2)9-19-13(3,10-20(14,15,16,17)18)12-7-5-4-6-8-12/h4-8H,1,9-10H2,2-3H3
InChIKey POJWRIJGDVBRHX-UHFFFAOYSA-N
Mol Weight 316.33 g/mol
Molecular Formula C13H17F5OS
Exact Mass 316.092027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQMdyDf2C0c
Name pentafluoro(2-((2-methylallyl)oxy)-2-phenylpropyl)-lamda-6-sulfane
Appearance Colorless oil
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Formula C13H17F5OS
InChI InChI=1S/C13H17F5OS/c1-11(2)9-19-13(3,10-20(14,15,16,17)18)12-7-5-4-6-8-12/h4-8H,1,9-10H2,2-3H3
InChIKey POJWRIJGDVBRHX-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5975B VL
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910830
Molecular Weight 316.330 g/mol
Reported Formula C13H17F5OS
SMILES c1c(cccc1)C(C)(OCC(=C)C)CS(F)(F)(F)(F)F
SPLASH splash10-014i-3910000000-b67522bead68345a9bd3
Source of Spectrum ACI-59-SM166-24
Wiley ID 1856796