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Heptafluorobutyramide, N-benzyl-N-heptyl-

View entire compound with spectra: 1 NMR

Heptafluorobutyramide, N-benzyl-N-heptyl-
SpectraBase Compound ID Bchw8yJtUct
InChI InChI=1S/C18H22F7NO/c1-2-3-4-5-9-12-26(13-14-10-7-6-8-11-14)15(27)16(19,20)17(21,22)18(23,24)25/h6-8,10-11H,2-5,9,12-13H2,1H3
InChIKey BWGFKERBXZWOBS-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 94X8hG7xu2B
Name Heptafluorobutyramide, N-benzyl-N-heptyl-
Comments Computed using HOSE algorithm
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Exact Mass 401.158961472 u
Formula C18H22F7NO
InChI InChI=1S/C18H22F7NO/c1-2-3-4-5-9-12-26(13-14-10-7-6-8-11-14)15(27)16(19,20)17(21,22)18(23,24)25/h6-8,10-11H,2-5,9,12-13H2,1H3
InChIKey BWGFKERBXZWOBS-UHFFFAOYSA-N
Molecular Weight 401.369 g/mol
SMILES C(N(CCCCCCC)CC1=CC=CC=C1)(=O)C(C(C(F)(F)F)(F)F)(F)F