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3-Amino-3-(2-chloro-5-trifluoromethyl-phenyl)-propionic acid
SpectraBase Compound ID 1167ZQ9WNek
InChI InChI=1S/C10H9ClF3NO2/c11-7-2-1-5(10(12,13)14)3-6(7)8(15)4-9(16)17/h1-3,8H,4,15H2,(H,16,17)
InChIKey OFJSQJAEIZPBQE-UHFFFAOYSA-N
Mol Weight 267.64 g/mol
Molecular Formula C10H9ClF3NO2
Exact Mass 267.027391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTMdOhTgSFz
Name 3-Amino-3-(2-chloro-5-trifluoromethyl-phenyl)-propionic acid
Alternate Name(s) 3-Amino-3-[2-chloro-5-(trifluoromethyl)phenyl]propanoic acid 3-Azanyl-3-[2-chloranyl-5-(trifluoromethyl)phenyl]propanoic acid
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Formula C10H9ClF3NO2
InChI InChI=1S/C10H9ClF3NO2/c11-7-2-1-5(10(12,13)14)3-6(7)8(15)4-9(16)17/h1-3,8H,4,15H2,(H,16,17)
InChIKey OFJSQJAEIZPBQE-UHFFFAOYSA-N
Molecular Weight 267.635 g/mol
SMILES OC(CC(c1cc(C(F)(F)F)ccc1Cl)N)=O
SPLASH splash10-0a4l-9460000000-7ad91d8507527645fc3b
Wiley ID 1464807