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3-(2-Phenyl-1H-indol-1-yl)propanoic acid, tms derivative
SpectraBase Compound ID L0aFuhR4U8j
InChI InChI=1S/C20H23NO2Si/c1-24(2,3)23-20(22)13-14-21-18-12-8-7-11-17(18)15-19(21)16-9-5-4-6-10-16/h4-12,15H,13-14H2,1-3H3
InChIKey MTORZWIQFYGPEM-UHFFFAOYSA-N
Mol Weight 337.49 g/mol
Molecular Formula C20H23NO2Si
Exact Mass 337.149806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDgOBaxaxK6
Name 3-(2-Phenyl-1H-indol-1-yl)propanoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 337.149805518 u
Formula C20H23NO2Si
InChI InChI=1S/C20H23NO2Si/c1-24(2,3)23-20(22)13-14-21-18-12-8-7-11-17(18)15-19(21)16-9-5-4-6-10-16/h4-12,15H,13-14H2,1-3H3
InChIKey MTORZWIQFYGPEM-UHFFFAOYSA-N
Molecular Weight 337.494 g/mol
SMILES C1=2N(C(=CC2C=CC=C1)C1=CC=CC=C1)CCC(=O)O[Si](C)(C)C