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Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-pentyl)-N-tetradecyl-
SpectraBase Compound ID AqqxPYusanO
InChI InChI=1S/C27H43F4NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-21-32(22(3)18-5-2)26(33)23-19-17-20-24(25(23)28)27(29,30)31/h17,19-20,22H,4-16,18,21H2,1-3H3
InChIKey PIEXXUXQLJADQE-UHFFFAOYSA-N
Mol Weight 473.6 g/mol
Molecular Formula C27H43F4NO
Exact Mass 473.328078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1RFd1cctyh0
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-(2-pentyl)-N-tetradecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.328077660 u
Formula C27H43F4NO
InChI InChI=1S/C27H43F4NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-21-32(22(3)18-5-2)26(33)23-19-17-20-24(25(23)28)27(29,30)31/h17,19-20,22H,4-16,18,21H2,1-3H3
InChIKey PIEXXUXQLJADQE-UHFFFAOYSA-N
Molecular Weight 473.641 g/mol
SMILES C(C1=C(C(=CC=C1)C(F)(F)F)F)(N(CCCCCCCCCCCCCC)C(CCC)C)=O