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Dimethyl 4-[3-(benzyloxy)phenyl]-1,2,6-trimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
SpectraBase Compound ID EqV7i4jnDBw
InChI InChI=1S/C25H27NO5/c1-16-21(24(27)29-4)23(22(25(28)30-5)17(2)26(16)3)19-12-9-13-20(14-19)31-15-18-10-7-6-8-11-18/h6-14,23H,15H2,1-5H3
InChIKey ZRICWEFIUWJUPT-UHFFFAOYSA-N
Mol Weight 421.49 g/mol
Molecular Formula C25H27NO5
Exact Mass 421.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJVSQinaV4t
Name Dimethyl 4-[3-(benzyloxy)phenyl]-1,2,6-trimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 421.188922968 u
Formula C25H27NO5
InChI InChI=1S/C25H27NO5/c1-16-21(24(27)29-4)23(22(25(28)30-5)17(2)26(16)3)19-12-9-13-20(14-19)31-15-18-10-7-6-8-11-18/h6-14,23H,15H2,1-5H3
InChIKey ZRICWEFIUWJUPT-UHFFFAOYSA-N
Molecular Weight 421.493 g/mol
SMILES C1(=C(N(C)C(=C(C1C1=CC(OCC2=CC=CC=C2)=CC=C1)C(=O)OC)C)C)C(=O)OC