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Heptafluorobutanamide, N-(2-phenylethyl)-N-tetradecyl-
SpectraBase Compound ID 8R6jlrYQTaz
InChI InChI=1S/C26H38F7NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-20-34(21-19-22-17-14-13-15-18-22)23(35)24(27,28)25(29,30)26(31,32)33/h13-15,17-18H,2-12,16,19-21H2,1H3
InChIKey ZFEWKJYREKOVBL-UHFFFAOYSA-N
Mol Weight 513.6 g/mol
Molecular Formula C26H38F7NO
Exact Mass 513.284162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VzEDLdlEwI
Name Heptafluorobutanamide, N-(2-phenylethyl)-N-tetradecyl-
Comments Computed using HOSE algorithm
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Exact Mass 513.284161988 u
Formula C26H38F7NO
InChI InChI=1S/C26H38F7NO/c1-2-3-4-5-6-7-8-9-10-11-12-16-20-34(21-19-22-17-14-13-15-18-22)23(35)24(27,28)25(29,30)26(31,32)33/h13-15,17-18H,2-12,16,19-21H2,1H3
InChIKey ZFEWKJYREKOVBL-UHFFFAOYSA-N
Molecular Weight 513.585 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)CCCCCCCCCCCCCC