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Benzamide, 3-trifluoromethyl-N-(2-pentyl)-N-hexadecyl-
SpectraBase Compound ID ICOmgfauQgc
InChI InChI=1S/C29H48F3NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-33(25(3)20-5-2)28(34)26-21-19-22-27(24-26)29(30,31)32/h19,21-22,24-25H,4-18,20,23H2,1-3H3
InChIKey WEEORELCRUNDJI-UHFFFAOYSA-N
Mol Weight 483.7 g/mol
Molecular Formula C29H48F3NO
Exact Mass 483.3688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfvUbNACLJW
Name Benzamide, 3-trifluoromethyl-N-(2-pentyl)-N-hexadecyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.368799658 u
Formula C29H48F3NO
InChI InChI=1S/C29H48F3NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-23-33(25(3)20-5-2)28(34)26-21-19-22-27(24-26)29(30,31)32/h19,21-22,24-25H,4-18,20,23H2,1-3H3
InChIKey WEEORELCRUNDJI-UHFFFAOYSA-N
Molecular Weight 483.704 g/mol
SMILES C(N(C(CCC)C)C(=O)C1=CC(C(F)(F)F)=CC=C1)CCCCCCCCCCCCCCC