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2-{[(4-chlorophenyl)(phenyl)methyl]amino}benzoic acid, tms derivative

View entire compound with spectra: 1 NMR

2-{[(4-chlorophenyl)(phenyl)methyl]amino}benzoic acid, tms derivative
SpectraBase Compound ID HqR4w2e2nZI
InChI InChI=1S/C23H24ClNO2Si/c1-28(2,3)27-23(26)20-11-7-8-12-21(20)25-22(17-9-5-4-6-10-17)18-13-15-19(24)16-14-18/h4-16,22,25H,1-3H3
InChIKey UCEMASCNMHXYQS-UHFFFAOYSA-N
Mol Weight 409.99 g/mol
Molecular Formula C23H24ClNO2Si
Exact Mass 409.126483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbHG8q7Wkfw
Name 2-{[(4-chlorophenyl)(phenyl)methyl]amino}benzoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 409.126483250 u
Formula C23H24ClNO2Si
InChI InChI=1S/C23H24ClNO2Si/c1-28(2,3)27-23(26)20-11-7-8-12-21(20)25-22(17-9-5-4-6-10-17)18-13-15-19(24)16-14-18/h4-16,22,25H,1-3H3
InChIKey UCEMASCNMHXYQS-UHFFFAOYSA-N
Molecular Weight 409.988 g/mol
SMILES C(C1=C(C=CC=C1)NC(C1=CC=CC=C1)C1=CC=C(C=C1)Cl)(=O)O[Si](C)(C)C