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4'-Chloro-3'-nitro-2-(alpha,alpha-alpha-trifluoro-m-toluidino)benzanilide

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4'-Chloro-3'-nitro-2-(alpha,alpha-alpha-trifluoro-m-toluidino)benzanilide
SpectraBase Compound ID L37UiCkq6P0
InChI InChI=1S/C20H13ClF3N3O3/c21-16-9-8-14(11-18(16)27(29)30)26-19(28)15-6-1-2-7-17(15)25-13-5-3-4-12(10-13)20(22,23)24/h1-11,25H,(H,26,28)
InChIKey AUPDGYTVFCTCFG-UHFFFAOYSA-N
Mol Weight 435.79 g/mol
Molecular Formula C20H13ClF3N3O3
Exact Mass 435.059753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eyz95uPzi0V
Name 4'-Chloro-3'-nitro-2-(alpha,alpha-alpha-trifluoro-m-toluidino)benzanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.059753477 u
Formula C20H13ClF3N3O3
InChI InChI=1S/C20H13ClF3N3O3/c21-16-9-8-14(11-18(16)27(29)30)26-19(28)15-6-1-2-7-17(15)25-13-5-3-4-12(10-13)20(22,23)24/h1-11,25H,(H,26,28)
InChIKey AUPDGYTVFCTCFG-UHFFFAOYSA-N
Molecular Weight 435.790 g/mol
SMILES N(C=1C=CC(=C(C1)N(=O)=O)Cl)C(C=1C(=CC=CC1)NC1=CC(=CC=C1)C(F)(F)F)=O