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3-Isopropyl 5-(2-methoxyethyl) 4-(3-aminophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
SpectraBase Compound ID GGv9DCitqui
InChI InChI=1S/C21H28N2O5/c1-12(2)28-21(25)18-14(4)23-13(3)17(20(24)27-10-9-26-5)19(18)15-7-6-8-16(22)11-15/h6-8,11-12,19,23H,9-10,22H2,1-5H3
InChIKey GUJDTMSUOZMUQI-UHFFFAOYSA-N
Mol Weight 388.46 g/mol
Molecular Formula C21H28N2O5
Exact Mass 388.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADw7lW50Hal
Name 3-Isopropyl 5-(2-methoxyethyl) 4-(3-aminophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 388.199822005 u
Formula C21H28N2O5
InChI InChI=1S/C21H28N2O5/c1-12(2)28-21(25)18-14(4)23-13(3)17(20(24)27-10-9-26-5)19(18)15-7-6-8-16(22)11-15/h6-8,11-12,19,23H,9-10,22H2,1-5H3
InChIKey GUJDTMSUOZMUQI-UHFFFAOYSA-N
Molecular Weight 388.464 g/mol
SMILES C1(=C(C(C(=C(N1)C)C(=O)OCCOC)C1=CC(=CC=C1)N)C(=O)OC(C)C)C