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Benzamide, 2-fluoro-5-trifluoromethyl-N-butyl-N-nonyl-
SpectraBase Compound ID 5Q0ZOJm8I2l
InChI InChI=1S/C21H31F4NO/c1-3-5-7-8-9-10-11-15-26(14-6-4-2)20(27)18-16-17(21(23,24)25)12-13-19(18)22/h12-13,16H,3-11,14-15H2,1-2H3
InChIKey FAUKRDMPURLTBQ-UHFFFAOYSA-N
Mol Weight 389.48 g/mol
Molecular Formula C21H31F4NO
Exact Mass 389.234177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CeX9Y9InwwV
Name Benzamide, 2-fluoro-5-trifluoromethyl-N-butyl-N-nonyl-
Comments Computed using HOSE algorithm
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Exact Mass 389.234177273 u
Formula C21H31F4NO
InChI InChI=1S/C21H31F4NO/c1-3-5-7-8-9-10-11-15-26(14-6-4-2)20(27)18-16-17(21(23,24)25)12-13-19(18)22/h12-13,16H,3-11,14-15H2,1-2H3
InChIKey FAUKRDMPURLTBQ-UHFFFAOYSA-N
Molecular Weight 389.479 g/mol
SMILES C1=CC(=C(C=C1C(F)(F)F)C(N(CCCCCCCCC)CCCC)=O)F