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3,3-DIFLUORO-3-OCTYLTHIOPROPAN-2-ONE
SpectraBase Compound ID HDmxFsRRvPg
InChI InChI=1S/C11H20F2OS/c1-3-4-5-6-7-8-9-15-11(12,13)10(2)14/h3-9H2,1-2H3
InChIKey UHRPKLCVXLAGJF-UHFFFAOYSA-N
Mol Weight 238.34 g/mol
Molecular Formula C11H20F2OS
Exact Mass 238.120293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ARKLAGJJBhl
Name 3,3-DIFLUORO-3-OCTYLTHIOPROPAN-2-ONE
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H20F2OS
InChI InChI=1S/C11H20F2OS/c1-3-4-5-6-7-8-9-15-11(12,13)10(2)14/h3-9H2,1-2H3
InChIKey UHRPKLCVXLAGJF-UHFFFAOYSA-N
Literature Reference Author C.QUERO,G.ROSELL,O.JIMENEZ,S.RODRIGUEZ,M.P.BOSCH,A.GUERRERO
Literature Reference Citation BIOORG.MED.CHEM.,11,1047(2003)
Literature Reference DOI 10.1016/S0968-0896(02)00467-4
Molecular Weight 238.336 g/mol
Sample ID 38543
Solvent Unknown