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Benzamide, 4-trifluoromethyl-N-(2-pentyl)-N-hexadecyl-
SpectraBase Compound ID H5sUU38FQqw
InChI InChI=1S/C29H48F3NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-24-33(25(3)19-5-2)28(34)26-20-22-27(23-21-26)29(30,31)32/h20-23,25H,4-19,24H2,1-3H3
InChIKey VQGQTAKCOLZLPK-UHFFFAOYSA-N
Mol Weight 483.7 g/mol
Molecular Formula C29H48F3NO
Exact Mass 483.3688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2F9TftiY7o1
Name Benzamide, 4-trifluoromethyl-N-(2-pentyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 483.368799658 u
Formula C29H48F3NO
InChI InChI=1S/C29H48F3NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-24-33(25(3)19-5-2)28(34)26-20-22-27(23-21-26)29(30,31)32/h20-23,25H,4-19,24H2,1-3H3
InChIKey VQGQTAKCOLZLPK-UHFFFAOYSA-N
Molecular Weight 483.704 g/mol
SMILES C(C1=CC=C(C=C1)C(F)(F)F)(=O)N(CCCCCCCCCCCCCCCC)C(CCC)C