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2,6-Dimethyl-1-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furoyl}piperidine
SpectraBase Compound ID 9Q6TbX94lyw
InChI InChI=1S/C19H19F4NO3/c1-10-4-3-5-11(2)24(10)19(25)15-7-6-12(27-15)9-26-18-16(22)13(20)8-14(21)17(18)23/h6-8,10-11H,3-5,9H2,1-2H3
InChIKey ONRXQJYDOVSGII-UHFFFAOYSA-N
Mol Weight 385.36 g/mol
Molecular Formula C19H19F4NO3
Exact Mass 385.130106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ovIMDGednL
Name 2,6-Dimethyl-1-{5-[(2,3,5,6-tetrafluorophenoxy)methyl]-2-furoyl}piperidine
Comments Computed using HOSE algorithm
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Exact Mass 385.130106125 u
Formula C19H19F4NO3
InChI InChI=1S/C19H19F4NO3/c1-10-4-3-5-11(2)24(10)19(25)15-7-6-12(27-15)9-26-18-16(22)13(20)8-14(21)17(18)23/h6-8,10-11H,3-5,9H2,1-2H3
InChIKey ONRXQJYDOVSGII-UHFFFAOYSA-N
Molecular Weight 385.359 g/mol
SMILES C=1(C(=C(C=C(C1F)F)F)F)OCC=1OC(C(N2C(CCCC2C)C)=O)=CC1