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Benzamide, 4-(trifluoromethyl)-N-(2-phenylethyl)-N-dodecyl-
SpectraBase Compound ID AJIEUBvOXJ1
InChI InChI=1S/C28H38F3NO/c1-2-3-4-5-6-7-8-9-10-14-22-32(23-21-24-15-12-11-13-16-24)27(33)25-17-19-26(20-18-25)28(29,30)31/h11-13,15-20H,2-10,14,21-23H2,1H3
InChIKey OXMUWHXNYOLBLL-UHFFFAOYSA-N
Mol Weight 461.6 g/mol
Molecular Formula C28H38F3NO
Exact Mass 461.290549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3wyEWoktX4V
Name Benzamide, 4-(trifluoromethyl)-N-(2-phenylethyl)-N-dodecyl-
Comments Computed using HOSE algorithm
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Exact Mass 461.290549336 u
Formula C28H38F3NO
InChI InChI=1S/C28H38F3NO/c1-2-3-4-5-6-7-8-9-10-14-22-32(23-21-24-15-12-11-13-16-24)27(33)25-17-19-26(20-18-25)28(29,30)31/h11-13,15-20H,2-10,14,21-23H2,1H3
InChIKey OXMUWHXNYOLBLL-UHFFFAOYSA-N
Molecular Weight 461.613 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)C(F)(F)F)CCCCCCCCCCCC