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Benzoic acid, 3-[(trichloroacetyl)amino]-
SpectraBase Compound ID LTo8Z2RCq2P
InChI InChI=1S/C9H6Cl3NO3/c10-9(11,12)8(16)13-6-3-1-2-5(4-6)7(14)15/h1-4H,(H,13,16)(H,14,15)
InChIKey NVEFEJPHLKPKIK-UHFFFAOYSA-N
Mol Weight 282.51 g/mol
Molecular Formula C9H6Cl3NO3
Exact Mass 280.941326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nePNbIK66u
Name Benzoic acid, 3-[(trichloroacetyl)amino]-
CAS Registry Number 56177-39-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6Cl3NO3
InChI InChI=1S/C9H6Cl3NO3/c10-9(11,12)8(16)13-6-3-1-2-5(4-6)7(14)15/h1-4H,(H,13,16)(H,14,15)
InChIKey NVEFEJPHLKPKIK-UHFFFAOYSA-N
Molecular Weight 282.510 g/mol
SMILES N(c1cccc(C(O)=O)c1)C(C(Cl)(Cl)Cl)=O
SPLASH splash10-03di-4900000000-7ba268d6622790d2d0da
Source of Spectrum O-10-29-1
Synonyms 3-[(Trichloroacetyl)amino]benzoic acid 3-[(2,2,2-trichloro-1-oxoethyl)amino]benzoic acid 3-[(2,2,2-trichloroacetyl)amino]benzoic acid 3-[2,2,2-tris(chloranyl)ethanoylamino]benzoic acid
Wiley ID 1284592