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3-(Trifluoromethyl) benzamide, N-(2-phenylethyl)-N-hexyl-
SpectraBase Compound ID J9UjgzSz9Wo
InChI InChI=1S/C22H26F3NO/c1-2-3-4-8-15-26(16-14-18-10-6-5-7-11-18)21(27)19-12-9-13-20(17-19)22(23,24)25/h5-7,9-13,17H,2-4,8,14-16H2,1H3
InChIKey GNWJHTSFHPBZRK-UHFFFAOYSA-N
Mol Weight 377.45 g/mol
Molecular Formula C22H26F3NO
Exact Mass 377.196649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JxQmuwe7b5D
Name 3-(Trifluoromethyl) benzamide, N-(2-phenylethyl)-N-hexyl-
Comments Computed using HOSE algorithm
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Exact Mass 377.196648949 u
Formula C22H26F3NO
InChI InChI=1S/C22H26F3NO/c1-2-3-4-8-15-26(16-14-18-10-6-5-7-11-18)21(27)19-12-9-13-20(17-19)22(23,24)25/h5-7,9-13,17H,2-4,8,14-16H2,1H3
InChIKey GNWJHTSFHPBZRK-UHFFFAOYSA-N
Molecular Weight 377.451 g/mol
SMILES C1(=CC=CC=C1)CCN(C(=O)C1=CC(C(F)(F)F)=CC=C1)CCCCCC