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Methyl 2-(hydroxydiphenylmethyl)-1-methoxymethylindole-3-carboxylate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl 2-(hydroxydiphenylmethyl)-1-methoxymethylindole-3-carboxylate
SpectraBase Compound ID 7S4uMyubPYI
InChI InChI=1S/C25H23NO4/c1-29-17-26-21-16-10-9-15-20(21)22(24(27)30-2)23(26)25(28,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-16,28H,17H2,1-2H3
InChIKey IHUSXTXRKPYZLK-UHFFFAOYSA-N
Mol Weight 401.46 g/mol
Molecular Formula C25H23NO4
Exact Mass 401.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FSeHJYNi2xS
Name Methyl 2-(hydroxydiphenylmethyl)-1-methoxymethylindole-3-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 401.162708221 u
Formula C25H23NO4
InChI InChI=1S/C25H23NO4/c1-29-17-26-21-16-10-9-15-20(21)22(24(27)30-2)23(26)25(28,18-11-5-3-6-12-18)19-13-7-4-8-14-19/h3-16,28H,17H2,1-2H3
InChIKey IHUSXTXRKPYZLK-UHFFFAOYSA-N
Molecular Weight 401.462 g/mol
SMILES C1(=C(N(COC)C=2C1=CC=CC2)C(C=1C=CC=CC1)(C1=CC=CC=C1)O)C(=O)OC