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(E)-1-cyclohexyl-2-fluoro-3-hydroxy-2-(1,1,2,2,2-pentafluoroethyl)-4-hexen-1-one

View entire compound with spectra: 1 MS (GC)

(E)-1-cyclohexyl-2-fluoro-3-hydroxy-2-(1,1,2,2,2-pentafluoroethyl)-4-hexen-1-one
SpectraBase Compound ID K6lJRYzIpig
InChI InChI=1S/C14H18F6O2/c1-2-6-10(21)12(15,13(16,17)14(18,19)20)11(22)9-7-4-3-5-8-9/h2,6,9-10,21H,3-5,7-8H2,1H3/b6-2+
InChIKey PSROGBUUDZAZFC-QHHAFSJGSA-N
Mol Weight 332.29 g/mol
Molecular Formula C14H18F6O2
Exact Mass 332.121099 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CSmBbFe4tbW
Name (E)-1-cyclohexyl-2-fluoro-3-hydroxy-2-(1,1,2,2,2-pentafluoroethyl)-4-hexen-1-one
Alternate Name(s) (4E)-1-cyclohexyl-2-fluoro-3-hydroxy-2-(1,1,2,2,2-pentafluoroethyl)-4-hexen-1-one
CAS Registry Number 125762-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18F6O2
InChI InChI=1S/C14H18F6O2/c1-2-6-10(21)12(15,13(16,17)14(18,19)20)11(22)9-7-4-3-5-8-9/h2,6,9-10,21H,3-5,7-8H2,1H3/b6-2+
InChIKey PSROGBUUDZAZFC-QHHAFSJGSA-N
Molecular Weight 332.286 g/mol
SMILES OC(C(C(C(F)(F)F)(F)F)(C(=O)C1CCCCC1)F)\C=C\C
SPLASH splash10-001i-9200000000-af767e9c75f85f7dd119
Source of Spectrum J-55-3113-5
Wiley ID 1329059