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Benzamide, pentafluoro-N-(2-phenylethyl)-N-heptyl-

View entire compound with spectra: 1 NMR

Benzamide, pentafluoro-N-(2-phenylethyl)-N-heptyl-
SpectraBase Compound ID CSHxu8D6Fgf
InChI InChI=1S/C22H24F5NO/c1-2-3-4-5-9-13-28(14-12-15-10-7-6-8-11-15)22(29)16-17(23)19(25)21(27)20(26)18(16)24/h6-8,10-11H,2-5,9,12-14H2,1H3
InChIKey OVBDSBNURPQVDJ-UHFFFAOYSA-N
Mol Weight 413.43 g/mol
Molecular Formula C22H24F5NO
Exact Mass 413.177805 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B62MaMbnCJT
Name Benzamide, pentafluoro-N-(2-phenylethyl)-N-heptyl-
Comments Computed using HOSE algorithm
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Exact Mass 413.177805211 u
Formula C22H24F5NO
InChI InChI=1S/C22H24F5NO/c1-2-3-4-5-9-13-28(14-12-15-10-7-6-8-11-15)22(29)16-17(23)19(25)21(27)20(26)18(16)24/h6-8,10-11H,2-5,9,12-14H2,1H3
InChIKey OVBDSBNURPQVDJ-UHFFFAOYSA-N
Molecular Weight 413.432 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C(=C(C(F)=C(C1F)F)F)F)CCCCCCC