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Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-tetradecyl-
SpectraBase Compound ID 5w8wU3E27gz
InChI InChI=1S/C27H43F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-17-22-32(21-16-6-4-2)26(33)23-19-18-20-24(25(23)28)27(29,30)31/h18-20H,3-17,21-22H2,1-2H3
InChIKey COZRBCAXJSAUFH-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 D4Qqdkuxxhc
Name Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-tetradecyl-
Comments Computed using HOSE algorithm
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Exact Mass 473.328077660 u
Formula C27H43F4NO
InChI InChI=1S/C27H43F4NO/c1-3-5-7-8-9-10-11-12-13-14-15-17-22-32(21-16-6-4-2)26(33)23-19-18-20-24(25(23)28)27(29,30)31/h18-20H,3-17,21-22H2,1-2H3
InChIKey COZRBCAXJSAUFH-UHFFFAOYSA-N
Molecular Weight 473.641 g/mol
SMILES C1=CC=C(C(=C1C(=O)N(CCCCC)CCCCCCCCCCCCCC)F)C(F)(F)F