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Benzamide, 2-fluoro-6-trifluoromethyl-N-butyl-N-hexadecyl-
SpectraBase Compound ID 3gEemg0ggPx
InChI InChI=1S/C28H45F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-23-33(22-6-4-2)27(34)26-24(28(30,31)32)20-19-21-25(26)29/h19-21H,3-18,22-23H2,1-2H3
InChIKey PWJVSNIUTXMJRD-UHFFFAOYSA-N
Mol Weight 487.7 g/mol
Molecular Formula C28H45F4NO
Exact Mass 487.343728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9z6QkeyBFG
Name Benzamide, 2-fluoro-6-trifluoromethyl-N-butyl-N-hexadecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 487.343727724 u
Formula C28H45F4NO
InChI InChI=1S/C28H45F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-23-33(22-6-4-2)27(34)26-24(28(30,31)32)20-19-21-25(26)29/h19-21H,3-18,22-23H2,1-2H3
InChIKey PWJVSNIUTXMJRD-UHFFFAOYSA-N
Molecular Weight 487.668 g/mol
SMILES C1=CC(=C(C(=C1)C(F)(F)F)C(N(CCCCCCCCCCCCCCCC)CCCC)=O)F