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Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-undecyl-
SpectraBase Compound ID LXzy97LUgcO
InChI InChI=1S/C27H35F4NO/c1-2-3-4-5-6-7-8-9-13-20-32(21-19-22-15-11-10-12-16-22)26(33)23-17-14-18-24(25(23)28)27(29,30)31/h10-12,14-18H,2-9,13,19-21H2,1H3
InChIKey ZBACRGZEUKLCGN-UHFFFAOYSA-N
Mol Weight 465.6 g/mol
Molecular Formula C27H35F4NO
Exact Mass 465.265477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID kZNhD9p06H
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-phenylethyl)-N-undecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 465.265477402 u
Formula C27H35F4NO
InChI InChI=1S/C27H35F4NO/c1-2-3-4-5-6-7-8-9-13-20-32(21-19-22-15-11-10-12-16-22)26(33)23-17-14-18-24(25(23)28)27(29,30)31/h10-12,14-18H,2-9,13,19-21H2,1H3
InChIKey ZBACRGZEUKLCGN-UHFFFAOYSA-N
Molecular Weight 465.577 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(C1F)C(F)(F)F)CCCCCCCCCCC