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D-Allylglycine, N-pentafluoropropionyl-, hexadecyl ester

View entire compound with spectra: 1 NMR

D-Allylglycine, N-pentafluoropropionyl-, hexadecyl ester
SpectraBase Compound ID EHGANEnY5sf
InChI InChI=1S/C24H40F5NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-33-21(31)20(18-4-2)30-22(32)23(25,26)24(27,28)29/h4,20H,2-3,5-19H2,1H3,(H,30,32)
InChIKey HDIJCTHYKXFMIU-UHFFFAOYSA-N
Mol Weight 485.6 g/mol
Molecular Formula C24H40F5NO3
Exact Mass 485.292835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E9yIsP2w3nX
Name D-Allylglycine, N-pentafluoropropionyl-, hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 485.292834964 u
Formula C24H40F5NO3
InChI InChI=1S/C24H40F5NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-33-21(31)20(18-4-2)30-22(32)23(25,26)24(27,28)29/h4,20H,2-3,5-19H2,1H3,(H,30,32)
InChIKey HDIJCTHYKXFMIU-UHFFFAOYSA-N
Molecular Weight 485.580 g/mol
SMILES C=CCC(NC(C(C(F)(F)F)(F)F)=O)C(OCCCCCCCCCCCCCCCC)=O