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[bis(trifluoromethyl)methyl] N-[(pentafluoroethylcarbonyl]-2-amino-4-methylpentanoate
SpectraBase Compound ID 7XShO0JL7SR
InChI InChI=1S/C12H12F11NO3/c1-4(2)3-5(24-8(26)9(13,14)12(21,22)23)6(25)27-7(10(15,16)17)11(18,19)20/h4-5,7H,3H2,1-2H3,(H,24,26)
InChIKey ATSUCSPJRUYKFE-UHFFFAOYSA-N
Mol Weight 427.21 g/mol
Molecular Formula C12H12F11NO3
Exact Mass 427.064153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AU2SDWWIzZ
Name [bis(trifluoromethyl)methyl] N-[(pentafluoroethylcarbonyl]-2-amino-4-methylpentanoate
Alternate Name(s) 2,2,2-trifluoro-1-(trifluoromethyl)ethyl 4-methyl-2-[(2,2,3,3,3-pentafluoropropanoyl)amino]pentanoate
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Formula C12H12F11NO3
InChI InChI=1S/C12H12F11NO3/c1-4(2)3-5(24-8(26)9(13,14)12(21,22)23)6(25)27-7(10(15,16)17)11(18,19)20/h4-5,7H,3H2,1-2H3,(H,24,26)
InChIKey ATSUCSPJRUYKFE-UHFFFAOYSA-N
Molecular Weight 427.214 g/mol
SMILES N(C(C(C(F)(F)F)(F)F)=O)C(C(OC(C(F)(F)F)C(F)(F)F)=O)CC(C)C
SPLASH splash10-0ue9-0094000000-14e65da6aae3b1cce6cf
Source of Spectrum JC-425-250-0
Wiley ID 1380312