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N-{2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}-2-furamide
SpectraBase Compound ID JBqwtObJmAo
InChI InChI=1S/C25H24N2O6/c1-29-21-11-15-7-8-26-19(17(15)13-23(21)31-3)10-16-12-22(30-2)24(32-4)14-18(16)27-25(28)20-6-5-9-33-20/h5-9,11-14H,10H2,1-4H3,(H,27,28)
InChIKey RJOQHVWKIKROAJ-UHFFFAOYSA-N
Mol Weight 448.48 g/mol
Molecular Formula C25H24N2O6
Exact Mass 448.163436 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LfcAR5BBQUX
Name N-{2-[(6,7-Dimethoxy-1-isoquinolinyl)methyl]-4,5-dimethoxyphenyl}-2-furamide
Comments Computed using HOSE algorithm
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Exact Mass 448.163436495 u
Formula C25H24N2O6
InChI InChI=1S/C25H24N2O6/c1-29-21-11-15-7-8-26-19(17(15)13-23(21)31-3)10-16-12-22(30-2)24(32-4)14-18(16)27-25(28)20-6-5-9-33-20/h5-9,11-14H,10H2,1-4H3,(H,27,28)
InChIKey RJOQHVWKIKROAJ-UHFFFAOYSA-N
Molecular Weight 448.475 g/mol
SMILES N(C=1C(CC=2C=3C=C(OC)C(=CC3C=CN2)OC)=CC(=C(C1)OC)OC)C(C=1OC=CC1)=O