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Benzamide, 2-trifluoromethyl-N-(2-pentyl)-N-hexadecyl-
SpectraBase Compound ID AjjWEUZ78cF
InChI InChI=1S/C29H48F3NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-24-33(25(3)21-5-2)28(34)26-22-18-19-23-27(26)29(30,31)32/h18-19,22-23,25H,4-17,20-21,24H2,1-3H3
InChIKey OORXPVJRPSFMTE-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 4pzDunC6RuM
Name Benzamide, 2-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/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-24-33(25(3)21-5-2)28(34)26-22-18-19-23-27(26)29(30,31)32/h18-19,22-23,25H,4-17,20-21,24H2,1-3H3
InChIKey OORXPVJRPSFMTE-UHFFFAOYSA-N
Molecular Weight 483.704 g/mol
SMILES C(N(C(CCC)C)C(=O)C=1C(C(F)(F)F)=CC=CC1)CCCCCCCCCCCCCCC