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2-[[1,1,1,3,3,3-hexafluoro-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]propan-2-yl]amino]benzoic acid

View entire compound with spectra: 2 MS (GC)

2-[[1,1,1,3,3,3-hexafluoro-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]propan-2-yl]amino]benzoic acid
SpectraBase Compound ID ARegtwlzqF8
InChI InChI=1S/C14H8F12N2O3/c15-10(16,17)7(11(18,19)20)8(29)28-12(13(21,22)23,14(24,25)26)27-6-4-2-1-3-5(6)9(30)31/h1-4,7,27H,(H,28,29)(H,30,31)
InChIKey UJWIBHUOGPSQEP-UHFFFAOYSA-N
Mol Weight 480.21 g/mol
Molecular Formula C14H8F12N2O3
Exact Mass 480.03433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SeBqzvVvaL
Name 2-[[1,1,1,3,3,3-hexafluoro-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]propan-2-yl]amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8F12N2O3
InChI InChI=1S/C14H8F12N2O3/c15-10(16,17)7(11(18,19)20)8(29)28-12(13(21,22)23,14(24,25)26)27-6-4-2-1-3-5(6)9(30)31/h1-4,7,27H,(H,28,29)(H,30,31)
InChIKey UJWIBHUOGPSQEP-UHFFFAOYSA-N
Molecular Weight 480.210 g/mol
SMILES N(c1ccccc1C(=O)O)C(C(F)(F)F)(C(F)(F)F)NC(=O)C(C(F)(F)F)C(F)(F)F
SPLASH splash10-014l-9500000000-f11b7845402c9f0af192
Synonyms 2-[[1,1,1,3,3,3-hexafluoro-2-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]propan-2-yl]amino]benzoic acid 2-[[1,1,1,3,3,3-hexakis(fluoranyl)-2-[[3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoyl]amino]propan-2-yl]amino]benzoic acid 2-[[2,2,2-trifluoro-1-(trifluoromethyl)-1-[[3,3,3-trifluoro-2-(trifluoromethyl)propanoyl]amino]ethyl]amino]benzoic acid
Wiley ID 1468592