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Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-(2-heptyl)-

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Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-(2-heptyl)-
SpectraBase Compound ID 6MUn76wSQ5d
InChI InChI=1S/C23H27F4NO/c1-3-4-6-10-17(2)28(16-15-18-11-7-5-8-12-18)22(29)19-13-9-14-20(21(19)24)23(25,26)27/h5,7-9,11-14,17H,3-4,6,10,15-16H2,1-2H3
InChIKey DPEFTLGITOMJNR-UHFFFAOYSA-N
Mol Weight 409.47 g/mol
Molecular Formula C23H27F4NO
Exact Mass 409.202877 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QWZ7iSNwXi
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-(2-heptyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.202877144 u
Formula C23H27F4NO
InChI InChI=1S/C23H27F4NO/c1-3-4-6-10-17(2)28(16-15-18-11-7-5-8-12-18)22(29)19-13-9-14-20(21(19)24)23(25,26)27/h5,7-9,11-14,17H,3-4,6,10,15-16H2,1-2H3
InChIKey DPEFTLGITOMJNR-UHFFFAOYSA-N
Molecular Weight 409.469 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(C1F)C(F)(F)F)C(CCCCC)C