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4,4-Difluorocyclohexanecarboxylic acid, tms
SpectraBase Compound ID Ae2XRCv5YJw
InChI InChI=1S/C10H18F2O2Si/c1-15(2,3)14-9(13)8-4-6-10(11,12)7-5-8/h8H,4-7H2,1-3H3
InChIKey YYQAVIFQRMJPNF-UHFFFAOYSA-N
Mol Weight 236.33 g/mol
Molecular Formula C10H18F2O2Si
Exact Mass 236.104413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EBvfnfEbj8Z
Name 4,4-Difluorocyclohexanecarboxylic acid, tms
Comments Computed using HOSE algorithm
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Exact Mass 236.104412679 u
Formula C10H18F2O2Si
InChI InChI=1S/C10H18F2O2Si/c1-15(2,3)14-9(13)8-4-6-10(11,12)7-5-8/h8H,4-7H2,1-3H3
InChIKey YYQAVIFQRMJPNF-UHFFFAOYSA-N
Molecular Weight 236.334 g/mol
SMILES C[Si](OC(=O)C1CCC(F)(F)CC1)(C)C