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Benzamide, pentafluoro-N-(2-phenylethyl)-N-octyl-
SpectraBase Compound ID JsPEqXLAcc7
InChI InChI=1S/C23H26F5NO/c1-2-3-4-5-6-10-14-29(15-13-16-11-8-7-9-12-16)23(30)17-18(24)20(26)22(28)21(27)19(17)25/h7-9,11-12H,2-6,10,13-15H2,1H3
InChIKey CPJQOIBCLYGCFZ-UHFFFAOYSA-N
Mol Weight 427.46 g/mol
Molecular Formula C23H26F5NO
Exact Mass 427.193455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1YJ7PZjUzaZ
Name Benzamide, pentafluoro-N-(2-phenylethyl)-N-octyl-
Comments Computed using HOSE algorithm
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Exact Mass 427.193455275 u
Formula C23H26F5NO
InChI InChI=1S/C23H26F5NO/c1-2-3-4-5-6-10-14-29(15-13-16-11-8-7-9-12-16)23(30)17-18(24)20(26)22(28)21(27)19(17)25/h7-9,11-12H,2-6,10,13-15H2,1H3
InChIKey CPJQOIBCLYGCFZ-UHFFFAOYSA-N
Molecular Weight 427.459 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C(=C(C(F)=C(C1F)F)F)F)CCCCCCCC