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Perfluorobutyramide, N-allyl-N-octadecyl-
SpectraBase Compound ID 27T6kBnix6Y
InChI InChI=1S/C25H42F7NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-33(20-4-2)22(34)23(26,27)24(28,29)25(30,31)32/h4H,2-3,5-21H2,1H3
InChIKey MXKGSTQOIAVEPP-UHFFFAOYSA-N
Mol Weight 505.6 g/mol
Molecular Formula C25H42F7NO
Exact Mass 505.315462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IXpn40WMSuU
Name Perfluorobutyramide, N-allyl-N-octadecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 505.315462116 u
Formula C25H42F7NO
InChI InChI=1S/C25H42F7NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-33(20-4-2)22(34)23(26,27)24(28,29)25(30,31)32/h4H,2-3,5-21H2,1H3
InChIKey MXKGSTQOIAVEPP-UHFFFAOYSA-N
Molecular Weight 505.606 g/mol
SMILES C(N(CCCCCCCCCCCCCCCCCC)CC=C)(=O)C(C(C(F)(F)F)(F)F)(F)F