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4-Fluoro-3-hydroxy-4-(1,1,2,2,2-pentafluoroethyl)-5-undecanone

View entire compound with spectra: 1 MS (GC)

4-Fluoro-3-hydroxy-4-(1,1,2,2,2-pentafluoroethyl)-5-undecanone
SpectraBase Compound ID 3hgrAWdeyoP
InChI InChI=1S/C13H20F6O2/c1-3-5-6-7-8-10(21)11(14,9(20)4-2)12(15,16)13(17,18)19/h9,20H,3-8H2,1-2H3
InChIKey MLHZLVJKEKMSIG-UHFFFAOYSA-N
Mol Weight 322.29 g/mol
Molecular Formula C13H20F6O2
Exact Mass 322.136749 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MsRCMFCnlT
Name 4-Fluoro-3-hydroxy-4-(1,1,2,2,2-pentafluoroethyl)-5-undecanone
CAS Registry Number 114287-92-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20F6O2
InChI InChI=1S/C13H20F6O2/c1-3-5-6-7-8-10(21)11(14,9(20)4-2)12(15,16)13(17,18)19/h9,20H,3-8H2,1-2H3
InChIKey MLHZLVJKEKMSIG-UHFFFAOYSA-N
Molecular Weight 322.291 g/mol
SMILES OC(C(C(C(F)(F)F)(F)F)(C(=O)CCCCCC)F)CC
SPLASH splash10-03di-0900000000-9b4fd51c5c8a97dc123a
Source of Spectrum J-55-3112-5
Wiley ID 1321336