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L-Glutamic acid, N-trifluoroacetyl-, bis(2,2,3,3,3-pentafluoropropyl) ester

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L-Glutamic acid, N-trifluoroacetyl-, bis(2,2,3,3,3-pentafluoropropyl) ester
SpectraBase Compound ID Ikm4T5jdb11
InChI InChI=1S/C13H10F13NO5/c14-9(15,12(21,22)23)3-31-6(28)2-1-5(27-8(30)11(18,19)20)7(29)32-4-10(16,17)13(24,25)26/h5H,1-4H2,(H,27,30)
InChIKey RAALFVHWLBEPBO-UHFFFAOYSA-N
Mol Weight 507.2 g/mol
Molecular Formula C13H10F13NO5
Exact Mass 507.035139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 85gr5zb2Pgi
Name L-Glutamic acid, N-trifluoroacetyl-, bis(2,2,3,3,3-pentafluoropropyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 507.035138540 u
Formula C13H10F13NO5
InChI InChI=1S/C13H10F13NO5/c14-9(15,12(21,22)23)3-31-6(28)2-1-5(27-8(30)11(18,19)20)7(29)32-4-10(16,17)13(24,25)26/h5H,1-4H2,(H,27,30)
InChIKey RAALFVHWLBEPBO-UHFFFAOYSA-N
Molecular Weight 507.204 g/mol
SMILES C(C(C(OCC(C(F)(F)F)(F)F)=O)NC(C(F)(F)F)=O)CC(OCC(C(F)(F)F)(F)F)=O