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3,5-Pyridinedicarboxylic acid, 4-(2-fluorophenyl)-1,4-dihydro-1,2,6-trimethyl-, dimethyl ester

View entire compound with spectra: 2 NMR

3,5-Pyridinedicarboxylic acid, 4-(2-fluorophenyl)-1,4-dihydro-1,2,6-trimethyl-, dimethyl ester
SpectraBase Compound ID LVKpfWX0cTU
InChI InChI=1S/C18H20FNO4/c1-10-14(17(21)23-4)16(12-8-6-7-9-13(12)19)15(18(22)24-5)11(2)20(10)3/h6-9,16H,1-5H3
InChIKey PBIOKTDBWXPOAA-UHFFFAOYSA-N
Mol Weight 333.36 g/mol
Molecular Formula C18H20FNO4
Exact Mass 333.137636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4KehoCPyti8
Name 3,5-Pyridinedicarboxylic acid, 4-(2-fluorophenyl)-1,4-dihydro-1,2,6-trimethyl-, dimethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 333.137636287 u
Formula C18H20FNO4
InChI InChI=1S/C18H20FNO4/c1-10-14(17(21)23-4)16(12-8-6-7-9-13(12)19)15(18(22)24-5)11(2)20(10)3/h6-9,16H,1-5H3
InChIKey PBIOKTDBWXPOAA-UHFFFAOYSA-N
Molecular Weight 333.359 g/mol
SMILES C1(=C(N(C)C(=C(C1C1=C(F)C=CC=C1)C(=O)OC)C)C)C(=O)OC