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Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-octadecyl-

View entire compound with spectra: 1 NMR

Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-octadecyl-
SpectraBase Compound ID 1KbHDLh9wyW
InChI InChI=1S/C31H51F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26-36(25-20-6-4-2)30(37)27-23-22-24-28(29(27)32)31(33,34)35/h22-24H,3-21,25-26H2,1-2H3
InChIKey RLYMOOPPFKNNBY-UHFFFAOYSA-N
Mol Weight 529.7 g/mol
Molecular Formula C31H51F4NO
Exact Mass 529.390678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3YotAlATWdU
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-octadecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 529.390677917 u
Formula C31H51F4NO
InChI InChI=1S/C31H51F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-26-36(25-20-6-4-2)30(37)27-23-22-24-28(29(27)32)31(33,34)35/h22-24H,3-21,25-26H2,1-2H3
InChIKey RLYMOOPPFKNNBY-UHFFFAOYSA-N
Molecular Weight 529.749 g/mol
SMILES C1=CC=C(C(=C1C(=O)N(CCCCC)CCCCCCCCCCCCCCCCCC)F)C(F)(F)F