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Benzamide, 2-trifluoromethyl-N-(2-butyl)-N-dodecyl-
SpectraBase Compound ID B9B9fnLCrRJ
InChI InChI=1S/C24H38F3NO/c1-4-6-7-8-9-10-11-12-13-16-19-28(20(3)5-2)23(29)21-17-14-15-18-22(21)24(25,26)27/h14-15,17-18,20H,4-13,16,19H2,1-3H3
InChIKey LVQQUTCCCWHNHD-UHFFFAOYSA-N
Mol Weight 413.6 g/mol
Molecular Formula C24H38F3NO
Exact Mass 413.290549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3cOVOZI3O8c
Name Benzamide, 2-trifluoromethyl-N-(2-butyl)-N-dodecyl-
Comments Computed using HOSE algorithm
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Exact Mass 413.290549336 u
Formula C24H38F3NO
InChI InChI=1S/C24H38F3NO/c1-4-6-7-8-9-10-11-12-13-16-19-28(20(3)5-2)23(29)21-17-14-15-18-22(21)24(25,26)27/h14-15,17-18,20H,4-13,16,19H2,1-3H3
InChIKey LVQQUTCCCWHNHD-UHFFFAOYSA-N
Molecular Weight 413.569 g/mol
SMILES C(=O)(N(CCCCCCCCCCCC)C(CC)C)C=1C(C(F)(F)F)=CC=CC1