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Benzamide, 2,5-difluoro-N-(2-pentyl)-N-hexadecyl-

View entire compound with spectra: 1 NMR

Benzamide, 2,5-difluoro-N-(2-pentyl)-N-hexadecyl-
SpectraBase Compound ID BU7HF4YuXk0
InChI InChI=1S/C28H47F2NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-31(24(3)19-5-2)28(32)26-23-25(29)20-21-27(26)30/h20-21,23-24H,4-19,22H2,1-3H3
InChIKey DNGCNEQQDYWLAZ-UHFFFAOYSA-N
Mol Weight 451.7 g/mol
Molecular Formula C28H47F2NO
Exact Mass 451.362571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AIoXWfqHhX6
Name Benzamide, 2,5-difluoro-N-(2-pentyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 451.362571462 u
Formula C28H47F2NO
InChI InChI=1S/C28H47F2NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-31(24(3)19-5-2)28(32)26-23-25(29)20-21-27(26)30/h20-21,23-24H,4-19,22H2,1-3H3
InChIKey DNGCNEQQDYWLAZ-UHFFFAOYSA-N
Molecular Weight 451.687 g/mol
SMILES C(C1=C(C=CC(=C1)F)F)(N(CCCCCCCCCCCCCCCC)C(CCC)C)=O