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2H-pyran-4-carboxamide, tetrahydro-N-[4-[[(2-methylphenyl)amino]carbonyl]phenyl]-4-phenyl-
SpectraBase Compound ID 4NtIQ2eJI35
InChI InChI=1S/C26H26N2O3/c1-19-7-5-6-10-23(19)28-24(29)20-11-13-22(14-12-20)27-25(30)26(15-17-31-18-16-26)21-8-3-2-4-9-21/h2-14H,15-18H2,1H3,(H,27,30)(H,28,29)
InChIKey ALFUPHBMYWSGKR-UHFFFAOYSA-N
Mol Weight 414.51 g/mol
Molecular Formula C26H26N2O3
Exact Mass 414.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2euwQ6fx4ns
Name 2H-Pyran-4-carboxamide, tetrahydro-N-[4-[[(2-methylphenyl)amino]carbonyl]phenyl]-4-phenyl-
Comments Computed using HOSE algorithm
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Exact Mass 414.194342702 u
Formula C26H26N2O3
InChI InChI=1S/C26H26N2O3/c1-19-7-5-6-10-23(19)28-24(29)20-11-13-22(14-12-20)27-25(30)26(15-17-31-18-16-26)21-8-3-2-4-9-21/h2-14H,15-18H2,1H3,(H,27,30)(H,28,29)
InChIKey ALFUPHBMYWSGKR-UHFFFAOYSA-N
Molecular Weight 414.505 g/mol
SMILES N(C(C1(C2=CC=CC=C2)CCOCC1)=O)C=1C=CC(C(NC=2C(C)=CC=CC2)=O)=CC1