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Benzamide, 2-fluoro-5-trifluoromethyl-N-propyl-N-dodecyl-

View entire compound with spectra: 1 NMR

Benzamide, 2-fluoro-5-trifluoromethyl-N-propyl-N-dodecyl-
SpectraBase Compound ID B9TZBFDXBGZ
InChI InChI=1S/C23H35F4NO/c1-3-5-6-7-8-9-10-11-12-13-17-28(16-4-2)22(29)20-18-19(23(25,26)27)14-15-21(20)24/h14-15,18H,3-13,16-17H2,1-2H3
InChIKey QYCCAUKLCQUYHQ-UHFFFAOYSA-N
Mol Weight 417.5 g/mol
Molecular Formula C23H35F4NO
Exact Mass 417.265477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ugbGxHKBWn
Name Benzamide, 2-fluoro-5-trifluoromethyl-N-propyl-N-dodecyl-
Comments Computed using HOSE algorithm
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Exact Mass 417.265477402 u
Formula C23H35F4NO
InChI InChI=1S/C23H35F4NO/c1-3-5-6-7-8-9-10-11-12-13-17-28(16-4-2)22(29)20-18-19(23(25,26)27)14-15-21(20)24/h14-15,18H,3-13,16-17H2,1-2H3
InChIKey QYCCAUKLCQUYHQ-UHFFFAOYSA-N
Molecular Weight 417.533 g/mol
SMILES C(N(CCC)CCCCCCCCCCCC)(=O)C=1C(F)=CC=C(C(F)(F)F)C1