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Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-hexyl-
SpectraBase Compound ID 4a3KrRA56XQ
InChI InChI=1S/C22H25F4NO/c1-2-3-4-8-15-27(16-14-17-10-6-5-7-11-17)21(28)18-12-9-13-19(20(18)23)22(24,25)26/h5-7,9-13H,2-4,8,14-16H2,1H3
InChIKey LGMBQMIZVVZRGH-UHFFFAOYSA-N
Mol Weight 395.44 g/mol
Molecular Formula C22H25F4NO
Exact Mass 395.187227 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EIqSZEKAYJK
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-hexyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.187227080 u
Formula C22H25F4NO
InChI InChI=1S/C22H25F4NO/c1-2-3-4-8-15-27(16-14-17-10-6-5-7-11-17)21(28)18-12-9-13-19(20(18)23)22(24,25)26/h5-7,9-13H,2-4,8,14-16H2,1H3
InChIKey LGMBQMIZVVZRGH-UHFFFAOYSA-N
Molecular Weight 395.442 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(C1F)C(F)(F)F)CCCCCC