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pentafluoro(2-(penta-3,4-dien-1-yloxy)-2,2-diphenylethyl)-lamda-6-sulfane
SpectraBase Compound ID AB98DFii5VY
InChI InChI=1S/C19H19F5OS/c1-2-3-10-15-25-19(16-26(20,21,22,23)24,17-11-6-4-7-12-17)18-13-8-5-9-14-18/h3-9,11-14H,1,10,15-16H2
InChIKey NMDQSZGDBOAFIY-UHFFFAOYSA-N
Mol Weight 390.41 g/mol
Molecular Formula C19H19F5OS
Exact Mass 390.107677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2cmfDot4Lon
Name pentafluoro(2-(penta-3,4-dien-1-yloxy)-2,2-diphenylethyl)-lamda-6-sulfane
Appearance Colorless oil
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Formula C19H19F5OS
InChI InChI=1S/C19H19F5OS/c1-2-3-10-15-25-19(16-26(20,21,22,23)24,17-11-6-4-7-12-17)18-13-8-5-9-14-18/h3-9,11-14H,1,10,15-16H2
InChIKey NMDQSZGDBOAFIY-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5975B VL
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910830
Molecular Weight 390.412 g/mol
Reported Formula C19H19F5OS
SMILES c1c(cccc1)C(c1ccccc1)(OCCC=C=C)CS(F)(F)(F)(F)F
SPLASH splash10-0a6r-4903000000-4e2d2cbe7326056aa0cf
Source of Spectrum ACI-59-SM144-18
Thin-Layer Chromatography Rf = 0.3 (10% DCM in hexanes)
Wiley ID 1856789