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N-(3,4-dimethoxybenzyl)(4-methoxy-1-naphthyl)methanamine oxalate
SpectraBase Compound ID HL5ja4QnWIa
InChI InChI=1S/C21H23NO3.C2H2O4/c1-23-19-11-9-16(17-6-4-5-7-18(17)19)14-22-13-15-8-10-20(24-2)21(12-15)25-3;3-1(4)2(5)6/h4-12,22H,13-14H2,1-3H3;(H,3,4)(H,5,6)
InChIKey FFBVKIAMIXOVFX-UHFFFAOYSA-N
Mol Weight 427.45 g/mol
Molecular Formula C23H25NO7
Exact Mass 427.163102 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6fPEwL3Ie85
Name N-(3,4-Dimethoxybenzyl)(4-methoxy-1-naphthyl)methanamine oxalate
Comments Computed using HOSE algorithm
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Exact Mass 427.163102142 u
Formula C23H25NO7
InChI InChI=1S/C21H23NO3.C2H2O4/c1-23-19-11-9-16(17-6-4-5-7-18(17)19)14-22-13-15-8-10-20(24-2)21(12-15)25-3;3-1(4)2(5)6/h4-12,22H,13-14H2,1-3H3;(H,3,4)(H,5,6)
InChIKey FFBVKIAMIXOVFX-UHFFFAOYSA-N
Molecular Weight 427.453 g/mol
SMILES OC(C(O)=O)=O.N(CC1=C2C(=C(C=C1)OC)C=CC=C2)CC=1C=C(OC)C(=CC1)OC