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L-Lysine, N-methyl-N,N'-bis(trifluoroacetyl)-, methyl ester
SpectraBase Compound ID 9Phv70XdHf0
InChI InChI=1S/C12H16F6N2O4/c1-20(10(23)12(16,17)18)6-4-3-5-7(8(21)24-2)19-9(22)11(13,14)15/h7H,3-6H2,1-2H3,(H,19,22)
InChIKey QMJVVFVFGSNWNR-UHFFFAOYSA-N
Mol Weight 366.26 g/mol
Molecular Formula C12H16F6N2O4
Exact Mass 366.101426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GFeUl8zCCHq
Name L-Lysine, N-methyl-N,N'-bis(trifluoroacetyl)-, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 366.101425977 u
Formula C12H16F6N2O4
InChI InChI=1S/C12H16F6N2O4/c1-20(10(23)12(16,17)18)6-4-3-5-7(8(21)24-2)19-9(22)11(13,14)15/h7H,3-6H2,1-2H3,(H,19,22)
InChIKey QMJVVFVFGSNWNR-UHFFFAOYSA-N
Molecular Weight 366.260 g/mol
SMILES C(N(C(C(F)(F)F)=O)C)CCCC(C(OC)=O)NC(C(F)(F)F)=O