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Glycine, N-pentadecafluorooctanoyl-, heptadecyl ester

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Glycine, N-pentadecafluorooctanoyl-, heptadecyl ester
SpectraBase Compound ID 6Fmw8Z23NTg
InChI InChI=1S/C27H38F15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-46-19(44)18-43-20(45)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h2-18H2,1H3,(H,43,45)
InChIKey AYJFZCVYCQDUFS-UHFFFAOYSA-N
Mol Weight 709.6 g/mol
Molecular Formula C27H38F15NO3
Exact Mass 709.261217 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6aMQi7ZPprb
Name Glycine, N-pentadecafluorooctanoyl-, heptadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 709.261216530 u
Formula C27H38F15NO3
InChI InChI=1S/C27H38F15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-46-19(44)18-43-20(45)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h2-18H2,1H3,(H,43,45)
InChIKey AYJFZCVYCQDUFS-UHFFFAOYSA-N
Molecular Weight 709.581 g/mol
SMILES C(C(C(NCC(=O)OCCCCCCCCCCCCCCCCC)=O)(F)F)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F