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Benzamide, 2-fluoro-3-trifluoromethyl-N-propyl-N-dodecyl-
SpectraBase Compound ID EhDIXbl3yX8
InChI InChI=1S/C23H35F4NO/c1-3-5-6-7-8-9-10-11-12-13-18-28(17-4-2)22(29)19-15-14-16-20(21(19)24)23(25,26)27/h14-16H,3-13,17-18H2,1-2H3
InChIKey KHJUPYJLENUBOI-UHFFFAOYSA-N
Mol Weight 417.5 g/mol
Molecular Formula C23H35F4NO
Exact Mass 417.265477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 74EJCiHmJ04
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-propyl-N-dodecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.265477402 u
Formula C23H35F4NO
InChI InChI=1S/C23H35F4NO/c1-3-5-6-7-8-9-10-11-12-13-18-28(17-4-2)22(29)19-15-14-16-20(21(19)24)23(25,26)27/h14-16H,3-13,17-18H2,1-2H3
InChIKey KHJUPYJLENUBOI-UHFFFAOYSA-N
Molecular Weight 417.533 g/mol
SMILES C(N(CCC)CCCCCCCCCCCC)(=O)C=1C=CC=C(C(F)(F)F)C1F