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4,4,5,5,6,6,7,7,7-Nonafluoro-1-thiophen-3-yl-hept-1-yn-3-one
SpectraBase Compound ID 42ovvFtqOuV
InChI InChI=1S/C11H3F9OS/c12-8(13,7(21)2-1-6-3-4-22-5-6)9(14,15)10(16,17)11(18,19)20/h3-5H
InChIKey VFXBMTRMGJSEFR-UHFFFAOYSA-N
Mol Weight 354.19 g/mol
Molecular Formula C11H3F9OS
Exact Mass 353.976089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JpwV1NnyDkr
Name 4,4,5,5,6,6,7,7,7-Nonafluoro-1-thiophen-3-yl-hept-1-yn-3-one
Alternate Name(s) n-Perfluorobutyl 3-Thienylacetylenyl Ketone 4,4,5,5,6,6,7,7,7-nonafluoro-1-(3-thiophenyl)-1-heptyn-3-one 4,4,5,5,6,6,7,7,7-nonafluoro-1-thiophen-3-ylhept-1-yn-3-one 4,4,5,5,6,6,7,7,7-nonakis(fluoranyl)-1-thiophen-3-yl-hept-1-yn-3-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H3F9OS
InChI InChI=1S/C11H3F9OS/c12-8(13,7(21)2-1-6-3-4-22-5-6)9(14,15)10(16,17)11(18,19)20/h3-5H
InChIKey VFXBMTRMGJSEFR-UHFFFAOYSA-N
Molecular Weight 354.190 g/mol
SMILES C(C(C(F)(F)F)(F)F)(C(C(C#Cc1cscc1)=O)(F)F)(F)F
SPLASH splash10-000i-0901000000-ac83c67876e66b5663d9
Source of Spectrum U1-2010-7017-2o
Wiley ID 1664725