For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-(3,5-Bis(trifluoromethyl)phenyl)-1,1-difluorobut-1-en-3-yn-2-yl p-toluenesulfonate
SpectraBase Compound ID 4xx3o6vFIom
InChI InChI=1S/C19H10F8O3S/c1-11-2-5-15(6-3-11)31(28,29)30-16(17(20)21)7-4-12-8-13(18(22,23)24)10-14(9-12)19(25,26)27/h2-3,5-6,8-10H,1H3
InChIKey NIUQEZKGMKVURI-UHFFFAOYSA-N
Mol Weight 470.33 g/mol
Molecular Formula C19H10F8O3S
Exact Mass 470.022291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AmKpx7LU14C
Name 4-(3,5-Bis(trifluoromethyl)phenyl)-1,1-difluorobut-1-en-3-yn-2-yl p-toluenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H10F8O3S
InChI InChI=1S/C19H10F8O3S/c1-11-2-5-15(6-3-11)31(28,29)30-16(17(20)21)7-4-12-8-13(18(22,23)24)10-14(9-12)19(25,26)27/h2-3,5-6,8-10H,1H3
InChIKey NIUQEZKGMKVURI-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.jfluchem.2014.07.007
Molecular Weight 470.333 g/mol
SMILES c1c(C(F)(F)F)cc(cc1C(F)(F)F)C#CC(=C(F)F)OS(c1ccc(cc1)C)(=O)=O
SPLASH splash10-066u-8960000000-d32e4642240836e3482a
Source of Spectrum JFC-167-169-2c
Synonyms 4-(3,5-bis(trifluoromethyl)phenyl)-1,1-difluorobut-1-en-3-yn-2-yl 4-methylbenzenesulfonate
Wiley ID 1748071