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Benzamide, 3-fluoro-5-trifluoromethyl-N-butyl-N-octadecyl-

View entire compound with spectra: 1 NMR

Benzamide, 3-fluoro-5-trifluoromethyl-N-butyl-N-octadecyl-
SpectraBase Compound ID BMfPeOAV0KK
InChI InChI=1S/C30H49F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-35(21-6-4-2)29(36)26-23-27(30(32,33)34)25-28(31)24-26/h23-25H,3-22H2,1-2H3
InChIKey KKWQUOSCTOTFTD-UHFFFAOYSA-N
Mol Weight 515.7 g/mol
Molecular Formula C30H49F4NO
Exact Mass 515.375028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YAsX5zBQJO
Name Benzamide, 3-fluoro-5-trifluoromethyl-N-butyl-N-octadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 515.375027853 u
Formula C30H49F4NO
InChI InChI=1S/C30H49F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-35(21-6-4-2)29(36)26-23-27(30(32,33)34)25-28(31)24-26/h23-25H,3-22H2,1-2H3
InChIKey KKWQUOSCTOTFTD-UHFFFAOYSA-N
Molecular Weight 515.722 g/mol
SMILES C1=C(C=C(C=C1F)C(N(CCCC)CCCCCCCCCCCCCCCCCC)=O)C(F)(F)F