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Pentadecafluorooctanoylamide, N-benzyl-N-dodecyl-
SpectraBase Compound ID FHTtTsfBgvu
InChI InChI=1S/C27H32F15NO/c1-2-3-4-5-6-7-8-9-10-14-17-43(18-19-15-12-11-13-16-19)20(44)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h11-13,15-16H,2-10,14,17-18H2,1H3
InChIKey VTFACQXBZGDCCP-UHFFFAOYSA-N
Mol Weight 671.5 g/mol
Molecular Formula C27H32F15NO
Exact Mass 671.224437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4rhlpDXOkkU
Name Pentadecafluorooctanoylamide, N-benzyl-N-dodecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 671.224437098 u
Formula C27H32F15NO
InChI InChI=1S/C27H32F15NO/c1-2-3-4-5-6-7-8-9-10-14-17-43(18-19-15-12-11-13-16-19)20(44)21(28,29)22(30,31)23(32,33)24(34,35)25(36,37)26(38,39)27(40,41)42/h11-13,15-16H,2-10,14,17-18H2,1H3
InChIKey VTFACQXBZGDCCP-UHFFFAOYSA-N
Molecular Weight 671.535 g/mol
SMILES C1=CC=C(C=C1)CN(C(=O)C(C(F)(F)C(C(F)(F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)CCCCCCCCCCCC