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Heptafluorobutanamide, N-(2-phenylethyl)-N-hexyl-

View entire compound with spectra: 1 NMR

Heptafluorobutanamide, N-(2-phenylethyl)-N-hexyl-
SpectraBase Compound ID H2gMvXXCPI0
InChI InChI=1S/C18H22F7NO/c1-2-3-4-8-12-26(13-11-14-9-6-5-7-10-14)15(27)16(19,20)17(21,22)18(23,24)25/h5-7,9-10H,2-4,8,11-13H2,1H3
InChIKey CCPIMENTJBKTFN-UHFFFAOYSA-N
Mol Weight 401.37 g/mol
Molecular Formula C18H22F7NO
Exact Mass 401.158961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHtFiWhsnC5
Name Heptafluorobutanamide, N-(2-phenylethyl)-N-hexyl-
Comments Computed using HOSE algorithm
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Exact Mass 401.158961472 u
Formula C18H22F7NO
InChI InChI=1S/C18H22F7NO/c1-2-3-4-8-12-26(13-11-14-9-6-5-7-10-14)15(27)16(19,20)17(21,22)18(23,24)25/h5-7,9-10H,2-4,8,11-13H2,1H3
InChIKey CCPIMENTJBKTFN-UHFFFAOYSA-N
Molecular Weight 401.369 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C(C(C(F)(F)F)(F)F)(F)F)CCCCCC