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L-Prolyl-L-proline, N-pentafluoropropionyl-, propyl ester

View entire compound with spectra: 1 NMR

L-Prolyl-L-proline, N-pentafluoropropionyl-, propyl ester
SpectraBase Compound ID 8AcNeFyoiUW
InChI InChI=1S/C16H21F5N2O4/c1-2-9-27-13(25)11-6-4-7-22(11)12(24)10-5-3-8-23(10)14(26)15(17,18)16(19,20)21/h10-11H,2-9H2,1H3
InChIKey FVGIDYSSGWNEJZ-UHFFFAOYSA-N
Mol Weight 400.35 g/mol
Molecular Formula C16H21F5N2O4
Exact Mass 400.142148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6i4nNx0Qky
Name L-Prolyl-L-proline, N-pentafluoropropionyl-, propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 400.142147975 u
Formula C16H21F5N2O4
InChI InChI=1S/C16H21F5N2O4/c1-2-9-27-13(25)11-6-4-7-22(11)12(24)10-5-3-8-23(10)14(26)15(17,18)16(19,20)21/h10-11H,2-9H2,1H3
InChIKey FVGIDYSSGWNEJZ-UHFFFAOYSA-N
Molecular Weight 400.346 g/mol
SMILES CCCOC(C1CCCN1C(C1N(C(C(C(F)(F)F)(F)F)=O)CCC1)=O)=O