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Cyclopropanecarboxylic acid, 1-[(trifluoroacetyl)amino]-
SpectraBase Compound ID 1risQkEyLKy
InChI InChI=1S/C6H6F3NO3/c7-6(8,9)3(11)10-5(1-2-5)4(12)13/h1-2H2,(H,10,11)(H,12,13)
InChIKey ZWFYYKVOJQHLTH-UHFFFAOYSA-N
Mol Weight 197.11 g/mol
Molecular Formula C6H6F3NO3
Exact Mass 197.029978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fVkGJOjeMl
Name 1-[(trifluoroacetyl)amino]cyclopropanecarboxylic acid
Comments Note: The molecular formula of the structure shown is C6H6F3NO3 - which differs from the formula reported for the mass spectrum (C6H4D2F3NO3)
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Formula C6H4D2F3NO3
InChI InChI=1S/C6H6F3NO3/c7-6(8,9)3(11)10-5(1-2-5)4(12)13/h1-2H2,(H,10,11)(H,12,13)
InChIKey ZWFYYKVOJQHLTH-UHFFFAOYSA-N
Molecular Weight 197.113 g/mol
SMILES OC(C1(CC1)NC(=O)C(F)(F)F)=O
SPLASH splash10-0api-9400000000-3a72f4620ccd7f0e7582
Synonyms 1-[(2,2,2-trifluoro-1-oxoethyl)amino]-1-cyclopropanecarboxylic acid 1-[(2,2,2-trifluoroacetyl)amino]cyclopropane-1-carboxylic acid 1-[(2,2,2-trifluoroacetyl)amino]cyclopropanecarboxylic acid 1-[2,2,2-tris(fluoranyl)ethanoylamino]cyclopropane-1-carboxylic acid
Wiley ID 1480440