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(2-(but-3-yn-1-yloxy)-2,2-diphenylethyl)pentafluoro-lamda-6-sulfane
SpectraBase Compound ID 3wyyqsS70ZI
InChI InChI=1S/C18H17F5OS/c1-2-3-14-24-18(15-25(19,20,21,22)23,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h1,4-13H,3,14-15H2
InChIKey QTLAJEBCLJAOOD-UHFFFAOYSA-N
Mol Weight 376.39 g/mol
Molecular Formula C18H17F5OS
Exact Mass 376.092027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87uzucnuJom
Name (2-(but-3-yn-1-yloxy)-2,2-diphenylethyl)pentafluoro-lamda-6-sulfane
Appearance Colorless oil
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Formula C18H17F5OS
InChI InChI=1S/C18H17F5OS/c1-2-3-14-24-18(15-25(19,20,21,22)23,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h1,4-13H,3,14-15H2
InChIKey QTLAJEBCLJAOOD-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5975B VL
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910830
Molecular Weight 376.385 g/mol
Reported Formula C18H17F5OS
SMILES c1c(cccc1)C(c1ccccc1)(OCCC#C)CS(F)(F)(F)(F)F
SPLASH splash10-0570-2943000000-3d6b50d16ac8bbdb06cb
Source of Spectrum ACI-59-SM142-17
Thin-Layer Chromatography Rf = 0.2 (20% DCM in cyclohexanes)
Wiley ID 1856788