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2-Pyridinecarboxylic acid, 1,2-dihydro-2,2,4-trimethyl-6-quinolinyl ester
SpectraBase Compound ID 2lX5aJCqrZj
InChI InChI=1S/C18H18N2O2/c1-12-11-18(2,3)20-15-8-7-13(10-14(12)15)22-17(21)16-6-4-5-9-19-16/h4-11,20H,1-3H3
InChIKey RTRNOAZNGNPBCQ-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C18H18N2O2
Exact Mass 294.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 35x6dgBB1yv
Name 2-Pyridinecarboxylic acid, 1,2-dihydro-2,2,4-trimethyl-6-quinolinyl ester
Comments Computed using HOSE algorithm
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Exact Mass 294.136827826 u
Formula C18H18N2O2
InChI InChI=1S/C18H18N2O2/c1-12-11-18(2,3)20-15-8-7-13(10-14(12)15)22-17(21)16-6-4-5-9-19-16/h4-11,20H,1-3H3
InChIKey RTRNOAZNGNPBCQ-UHFFFAOYSA-N
Molecular Weight 294.354 g/mol
SMILES N1C2=C(C(=CC1(C)C)C)C=C(C=C2)OC(C=1N=CC=CC1)=O