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3-Amino-4-(trifluoromethyl)benzoic acid
SpectraBase Compound ID Aq6HPHiz8xO
InChI InChI=1S/C8H6F3NO2/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12/h1-3H,12H2,(H,13,14)
InChIKey RVYKHFGOJJKVNB-UHFFFAOYSA-N
Mol Weight 205.14 g/mol
Molecular Formula C8H6F3NO2
Exact Mass 205.035063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTuUG4xrDzP
Name 3-Amino-4-(trifluoromethyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F3NO2
InChI InChI=1S/C8H6F3NO2/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12/h1-3H,12H2,(H,13,14)
InChIKey RVYKHFGOJJKVNB-UHFFFAOYSA-N
Molecular Weight 205.136 g/mol
SMILES OC(c1ccc(c(c1)N)C(F)(F)F)=O
SPLASH splash10-0a4i-0790000000-a630e726198f8b39fd49
Source of Spectrum U-1997-1002-4
Synonyms 3-Azanyl-4-(trifluoromethyl)benzoic acid
Wiley ID 769745