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(Cyanocyclohexylidenemethyl)-nonafluorobutanesulfonate
SpectraBase Compound ID FYAT1WG0vnJ
InChI InChI=1S/C12H10F9NO3S/c13-9(14,11(17,18)19)10(15,16)12(20,21)26(23,24)25-8(6-22)7-4-2-1-3-5-7/h1-5H2
InChIKey RVCCWIRSKSAXLF-UHFFFAOYSA-N
Mol Weight 419.26 g/mol
Molecular Formula C12H10F9NO3S
Exact Mass 419.023768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 74oWegy7cOd
Name (Cyanocyclohexylidenemethyl)-nonafluorobutanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F9NO3S
InChI InChI=1S/C12H10F9NO3S/c13-9(14,11(17,18)19)10(15,16)12(20,21)26(23,24)25-8(6-22)7-4-2-1-3-5-7/h1-5H2
InChIKey RVCCWIRSKSAXLF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19861190228
Molecular Weight 419.262 g/mol
SMILES C(F)(C(F)(C(S(=O)(OC(=C1CCCCC1)C#N)=O)(F)F)F)(C(F)(F)F)F
SPLASH splash10-001i-9300000000-72d652e33a36b70c39b6
Source of Spectrum K-119-710-3d
Synonyms cyano(cyclohexylidene)methyl 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Wiley ID 1794461