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Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-hexadecyl-

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Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-hexadecyl-
SpectraBase Compound ID 415qJgJQWH
InChI InChI=1S/C32H39F8NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-41(29(42)23-18-16-20-25(27(23)33)31(35,36)37)30(43)24-19-17-21-26(28(24)34)32(38,39)40/h16-21H,2-15,22H2,1H3
InChIKey QONXEFXLVRUPHE-UHFFFAOYSA-N
Mol Weight 621.7 g/mol
Molecular Formula C32H39F8NO2
Exact Mass 621.285305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BfYpKsyNREu
Name Benzamide, 3-trifluoromethyl-2-fluoro-N-(3-trifluoromethyl-2-fluorobenzoyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
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Exact Mass 621.285304802 u
Formula C32H39F8NO2
InChI InChI=1S/C32H39F8NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-41(29(42)23-18-16-20-25(27(23)33)31(35,36)37)30(43)24-19-17-21-26(28(24)34)32(38,39)40/h16-21H,2-15,22H2,1H3
InChIKey QONXEFXLVRUPHE-UHFFFAOYSA-N
Molecular Weight 621.656 g/mol
SMILES C(N(CCCCCCCCCCCCCCCC)C(C1=C(C(C(F)(F)F)=CC=C1)F)=O)(=O)C=1C=CC=C(C(F)(F)F)C1F