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4-Chloro-2-[(2,4-dichlorobenzoyl)amino]benzoic acid, tms derivative
SpectraBase Compound ID GT6HaoKxcWF
InChI InChI=1S/C17H16Cl3NO3Si/c1-25(2,3)24-17(23)13-7-5-11(19)9-15(13)21-16(22)12-6-4-10(18)8-14(12)20/h4-9H,1-3H3,(H,21,22)
InChIKey BKJFYXSJLQTLJY-UHFFFAOYSA-N
Mol Weight 416.76 g/mol
Molecular Formula C17H16Cl3NO3Si
Exact Mass 414.996503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JBAI7jqw0ix
Name 4-Chloro-2-[(2,4-dichlorobenzoyl)amino]benzoic acid, tms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.996503011 u
Formula C17H16Cl3NO3Si
InChI InChI=1S/C17H16Cl3NO3Si/c1-25(2,3)24-17(23)13-7-5-11(19)9-15(13)21-16(22)12-6-4-10(18)8-14(12)20/h4-9H,1-3H3,(H,21,22)
InChIKey BKJFYXSJLQTLJY-UHFFFAOYSA-N
Molecular Weight 416.763 g/mol
SMILES C1(Cl)=C(C=CC(=C1)Cl)C(=O)NC1=C(C=CC(=C1)Cl)C(=O)O[Si](C)(C)C