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Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-3-methylbutyl-
SpectraBase Compound ID LiTIbTuzvP6
InChI InChI=1S/C18H25F4NO/c1-4-5-6-11-23(12-10-13(2)3)17(24)14-8-7-9-15(16(14)19)18(20,21)22/h7-9,13H,4-6,10-12H2,1-3H3
InChIKey ZPZBOJDBMAYOIE-UHFFFAOYSA-N
Mol Weight 347.4 g/mol
Molecular Formula C18H25F4NO
Exact Mass 347.187227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ElhvNeHcQ3g
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-3-methylbutyl-
Comments Computed using HOSE algorithm
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Exact Mass 347.187227080 u
Formula C18H25F4NO
InChI InChI=1S/C18H25F4NO/c1-4-5-6-11-23(12-10-13(2)3)17(24)14-8-7-9-15(16(14)19)18(20,21)22/h7-9,13H,4-6,10-12H2,1-3H3
InChIKey ZPZBOJDBMAYOIE-UHFFFAOYSA-N
Molecular Weight 347.398 g/mol
SMILES C1=CC=C(C(=C1C(=O)N(CCCCC)CCC(C)C)F)C(F)(F)F