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pentafluoro(2-(pent-3-yn-1-yloxy)-2-phenylpropyl)-lamda-6-sulfane
SpectraBase Compound ID K8V42EclKfm
InChI InChI=1S/C14H17F5OS/c1-3-4-8-11-20-14(2,12-21(15,16,17,18)19)13-9-6-5-7-10-13/h5-7,9-10H,8,11-12H2,1-2H3
InChIKey UVHHFJBCHQVBQQ-UHFFFAOYSA-N
Mol Weight 328.34 g/mol
Molecular Formula C14H17F5OS
Exact Mass 328.092027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBQ6wyXreUn
Name pentafluoro(2-(pent-3-yn-1-yloxy)-2-phenylpropyl)-lamda-6-sulfane
Appearance Colorless oil
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Formula C14H17F5OS
InChI InChI=1S/C14H17F5OS/c1-3-4-8-11-20-14(2,12-21(15,16,17,18)19)13-9-6-5-7-10-13/h5-7,9-10H,8,11-12H2,1-2H3
InChIKey UVHHFJBCHQVBQQ-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6890N-5975B VL
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910830
Molecular Weight 328.341 g/mol
Reported Formula C14H17F5OS
SMILES c1c(cccc1)C(C)(OCCC#CC)CS(F)(F)(F)(F)F
SPLASH splash10-03dj-0049000000-a8154d0481272b0e75b3
Source of Spectrum ACI-59-SM154-20
Wiley ID 1856791