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D-Allylglycine, N-heptafluorobutyryl-, tetradecyl ester

View entire compound with spectra: 1 NMR

D-Allylglycine, N-heptafluorobutyryl-, tetradecyl ester
SpectraBase Compound ID ESJftrEeYiO
InChI InChI=1S/C23H36F7NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-17-34-19(32)18(16-4-2)31-20(33)21(24,25)22(26,27)23(28,29)30/h4,18H,2-3,5-17H2,1H3,(H,31,33)
InChIKey QUIBAOMDAOISFZ-UHFFFAOYSA-N
Mol Weight 507.5 g/mol
Molecular Formula C23H36F7NO3
Exact Mass 507.258341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JwKJgiiWOxA
Name D-Allylglycine, N-heptafluorobutyryl-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 507.258341161 u
Formula C23H36F7NO3
InChI InChI=1S/C23H36F7NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-17-34-19(32)18(16-4-2)31-20(33)21(24,25)22(26,27)23(28,29)30/h4,18H,2-3,5-17H2,1H3,(H,31,33)
InChIKey QUIBAOMDAOISFZ-UHFFFAOYSA-N
Molecular Weight 507.534 g/mol
SMILES C(CCCCCCCCOC(C(NC(=O)C(C(C(F)(F)F)(F)F)(F)F)CC=C)=O)CCCCC