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N-[2-(3,4-diethoxyphenyl)ethyl]-2-(2-keto-3-methyl-benzimidazol-1-yl)acetamide
SpectraBase Compound ID 6sBUUbFwTVp
InChI InChI=1S/C22H27N3O4/c1-4-28-19-11-10-16(14-20(19)29-5-2)12-13-23-21(26)15-25-18-9-7-6-8-17(18)24(3)22(25)27/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,26)
InChIKey RTAGAYWPDHRKNF-UHFFFAOYSA-N
Mol Weight 397.48 g/mol
Molecular Formula C22H27N3O4
Exact Mass 397.200156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KvWApcazh4H
Name N-[2-(3,4-Diethoxyphenyl)ethyl]-2-(2-keto-3-methyl-benzimidazol-1-yl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 397.200156357 u
Formula C22H27N3O4
InChI InChI=1S/C22H27N3O4/c1-4-28-19-11-10-16(14-20(19)29-5-2)12-13-23-21(26)15-25-18-9-7-6-8-17(18)24(3)22(25)27/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,26)
InChIKey RTAGAYWPDHRKNF-UHFFFAOYSA-N
Molecular Weight 397.475 g/mol
SMILES C1(N(C=2C=CC=CC2N1C)CC(=O)NCCC=1C=C(OCC)C(=CC1)OCC)=O