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2-[(2-Chloroanilino)carbonyl]benzoic acid, tms derivative

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2-[(2-Chloroanilino)carbonyl]benzoic acid, tms derivative
SpectraBase Compound ID IGKt7S4mVwm
InChI InChI=1S/C17H18ClNO3Si/c1-23(2,3)22-17(21)13-9-5-4-8-12(13)16(20)19-15-11-7-6-10-14(15)18/h4-11H,1-3H3,(H,19,20)
InChIKey TYZZQNCTNPIFIV-UHFFFAOYSA-N
Mol Weight 347.87 g/mol
Molecular Formula C17H18ClNO3Si
Exact Mass 347.074448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dh1D9xD2yZA
Name 2-[(2-Chloroanilino)carbonyl]benzoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 347.074447676 u
Formula C17H18ClNO3Si
InChI InChI=1S/C17H18ClNO3Si/c1-23(2,3)22-17(21)13-9-5-4-8-12(13)16(20)19-15-11-7-6-10-14(15)18/h4-11H,1-3H3,(H,19,20)
InChIKey TYZZQNCTNPIFIV-UHFFFAOYSA-N
Molecular Weight 347.873 g/mol
SMILES C1(Cl)=C(C=CC=C1)NC(=O)C1=C(C=CC=C1)C(=O)O[Si](C)(C)C