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1-(3,4-Dimethoxyphenyl)-2-amino-3-cyano-4,4-bis(trifluoromethyl)-6-methyl-1,4-dihydropyridine

View entire compound with spectra: 2 NMR

1-(3,4-Dimethoxyphenyl)-2-amino-3-cyano-4,4-bis(trifluoromethyl)-6-methyl-1,4-dihydropyridine
SpectraBase Compound ID BCGAf3A0aQn
InChI InChI=1S/C17H15F6N3O2/c1-9-7-15(16(18,19)20,17(21,22)23)11(8-24)14(25)26(9)10-4-5-12(27-2)13(6-10)28-3/h4-7H,25H2,1-3H3
InChIKey QUSPXNDRRGSHGI-UHFFFAOYSA-N
Mol Weight 407.32 g/mol
Molecular Formula C17H15F6N3O2
Exact Mass 407.106846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8GbRHTW6kR1
Name 1-(3,4-Dimethoxyphenyl)-2-amino-3-cyano-4,4-bis(trifluoromethyl)-6-methyl-1,4-dihydropyridine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.106845711 u
Formula C17H15F6N3O2
InChI InChI=1S/C17H15F6N3O2/c1-9-7-15(16(18,19)20,17(21,22)23)11(8-24)14(25)26(9)10-4-5-12(27-2)13(6-10)28-3/h4-7H,25H2,1-3H3
InChIKey QUSPXNDRRGSHGI-UHFFFAOYSA-N
Molecular Weight 407.316 g/mol
SMILES NC1=C(C(C=C(C)N1c1cc(OC)c(cc1)OC)(C(F)(F)F)C(F)(F)F)C#N