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2-Amino-3-(trifluoromethoxy)benzoic acid
SpectraBase Compound ID FvRkn806d25
InChI InChI=1S/C8H6F3NO3/c9-8(10,11)15-5-3-1-2-4(6(5)12)7(13)14/h1-3H,12H2,(H,13,14)
InChIKey BQPQFVVEWXYRMH-UHFFFAOYSA-N
Mol Weight 221.14 g/mol
Molecular Formula C8H6F3NO3
Exact Mass 221.029978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SrkkoBIVc9
Name 2-Amino-3-(trifluoromethoxy)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F3NO3
InChI InChI=1S/C8H6F3NO3/c9-8(10,11)15-5-3-1-2-4(6(5)12)7(13)14/h1-3H,12H2,(H,13,14)
InChIKey BQPQFVVEWXYRMH-UHFFFAOYSA-N
Molecular Weight 221.135 g/mol
SMILES Nc1c(C(=O)O)cccc1OC(F)(F)F
SPLASH splash10-0fk9-0290000000-cb1e8ced4aed2fd39a90
Source of Spectrum F-68-4696-1
Synonyms 2-Azanyl-3-(trifluoromethyloxy)benzoic acid
Wiley ID 1572732