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Benzamide, 2-trifluoromethyl-N-(2-pentyl)-N-decyl-
SpectraBase Compound ID 1tOMyIlJ7DU
InChI InChI=1S/C23H36F3NO/c1-4-6-7-8-9-10-11-14-18-27(19(3)15-5-2)22(28)20-16-12-13-17-21(20)23(24,25)26/h12-13,16-17,19H,4-11,14-15,18H2,1-3H3
InChIKey KXHXCCGUFMJYJL-UHFFFAOYSA-N
Mol Weight 399.5 g/mol
Molecular Formula C23H36F3NO
Exact Mass 399.274899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K61BrEB6tIk
Name Benzamide, 2-trifluoromethyl-N-(2-pentyl)-N-decyl-
Comments Computed using HOSE algorithm
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Exact Mass 399.274899271 u
Formula C23H36F3NO
InChI InChI=1S/C23H36F3NO/c1-4-6-7-8-9-10-11-14-18-27(19(3)15-5-2)22(28)20-16-12-13-17-21(20)23(24,25)26/h12-13,16-17,19H,4-11,14-15,18H2,1-3H3
InChIKey KXHXCCGUFMJYJL-UHFFFAOYSA-N
Molecular Weight 399.542 g/mol
SMILES C(N(C(CCC)C)C(=O)C=1C(C(F)(F)F)=CC=CC1)CCCCCCCCC