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N-[2-(3,4-Dimethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-3-methylbutanamide, tms derivative
SpectraBase Compound ID EN3HaWWqzwK
InChI InChI=1S/C25H37NO4Si/c1-19(16-20-8-11-22(28-2)12-9-20)17-25(27)26(31(5,6)7)15-14-21-10-13-23(29-3)24(18-21)30-4/h8-13,18-19H,14-17H2,1-7H3
InChIKey XACWADRECUOJOH-UHFFFAOYSA-N
Mol Weight 443.7 g/mol
Molecular Formula C25H37NO4Si
Exact Mass 443.249185 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5347iDC7cJ
Name N-[2-(3,4-Dimethoxyphenyl)ethyl]-4-(4-methoxyphenyl)-3-methylbutanamide, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 443.249185206 u
Formula C25H37NO4Si
InChI InChI=1S/C25H37NO4Si/c1-19(16-20-8-11-22(28-2)12-9-20)17-25(27)26(31(5,6)7)15-14-21-10-13-23(29-3)24(18-21)30-4/h8-13,18-19H,14-17H2,1-7H3
InChIKey XACWADRECUOJOH-UHFFFAOYSA-N
Molecular Weight 443.659 g/mol
SMILES C(N(C(=O)CC(CC1=CC=C(C=C1)OC)C)[Si](C)(C)C)CC1=CC(=C(C=C1)OC)OC