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Glycine, N-pentadecafluorooctanoyl-, hexadecyl ester

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Glycine, N-pentadecafluorooctanoyl-, hexadecyl ester
SpectraBase Compound ID 3UPdLrx9xYk
InChI InChI=1S/C26H36F15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-45-18(43)17-42-19(44)20(27,28)21(29,30)22(31,32)23(33,34)24(35,36)25(37,38)26(39,40)41/h2-17H2,1H3,(H,42,44)
InChIKey SLUXUDRPHDQRND-UHFFFAOYSA-N
Mol Weight 695.6 g/mol
Molecular Formula C26H36F15NO3
Exact Mass 695.245566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7xHLvRvgviZ
Name Glycine, N-pentadecafluorooctanoyl-, hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 695.245566465 u
Formula C26H36F15NO3
InChI InChI=1S/C26H36F15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-45-18(43)17-42-19(44)20(27,28)21(29,30)22(31,32)23(33,34)24(35,36)25(37,38)26(39,40)41/h2-17H2,1H3,(H,42,44)
InChIKey SLUXUDRPHDQRND-UHFFFAOYSA-N
Molecular Weight 695.554 g/mol
SMILES C(C(C(NCC(=O)OCCCCCCCCCCCCCCCC)=O)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F