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Cinnamyl 2,3,3,3-tetrafluoropropanoate
SpectraBase Compound ID 2s59bFRHnig
InChI InChI=1S/C12H10F4O2/c13-10(12(14,15)16)11(17)18-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+
InChIKey FVAPRYGQEATQEZ-QPJJXVBHSA-N
Mol Weight 262.2 g/mol
Molecular Formula C12H10F4O2
Exact Mass 262.061692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjxTxYLLcER
Name Cinnamyl 2,3,3,3-tetrafluoropropanoate
Comments Computed using HOSE algorithm
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Exact Mass 262.061692212 u
Formula C12H10F4O2
InChI InChI=1S/C12H10F4O2/c13-10(12(14,15)16)11(17)18-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+
InChIKey FVAPRYGQEATQEZ-QPJJXVBHSA-N
Molecular Weight 262.204 g/mol
SMILES c1(ccccc1)\C=C\COC(=O)C(C(F)(F)F)F