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Benzamide, 2-fluoro-5-trifluoromethyl-N-benzyl-N-decyl-
SpectraBase Compound ID 4IjUFBq1wb0
InChI InChI=1S/C25H31F4NO/c1-2-3-4-5-6-7-8-12-17-30(19-20-13-10-9-11-14-20)24(31)22-18-21(25(27,28)29)15-16-23(22)26/h9-11,13-16,18H,2-8,12,17,19H2,1H3
InChIKey UDGZISIJPCQOPX-UHFFFAOYSA-N
Mol Weight 437.52 g/mol
Molecular Formula C25H31F4NO
Exact Mass 437.234177 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1Lq6lAFfj5
Name Benzamide, 2-fluoro-5-trifluoromethyl-N-benzyl-N-decyl-
Comments Computed using HOSE algorithm
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Exact Mass 437.234177273 u
Formula C25H31F4NO
InChI InChI=1S/C25H31F4NO/c1-2-3-4-5-6-7-8-12-17-30(19-20-13-10-9-11-14-20)24(31)22-18-21(25(27,28)29)15-16-23(22)26/h9-11,13-16,18H,2-8,12,17,19H2,1H3
InChIKey UDGZISIJPCQOPX-UHFFFAOYSA-N
Molecular Weight 437.523 g/mol
SMILES C1=C(C=CC(=C1C(N(CCCCCCCCCC)CC1=CC=CC=C1)=O)F)C(F)(F)F