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3-(Trifluoromethyl) benzamide, N-(2-phenylethyl)-N-undecyl-

View entire compound with spectra: 1 NMR

3-(Trifluoromethyl) benzamide, N-(2-phenylethyl)-N-undecyl-
SpectraBase Compound ID GKQ2gUKEUWV
InChI InChI=1S/C27H36F3NO/c1-2-3-4-5-6-7-8-9-13-20-31(21-19-23-15-11-10-12-16-23)26(32)24-17-14-18-25(22-24)27(28,29)30/h10-12,14-18,22H,2-9,13,19-21H2,1H3
InChIKey SAIUMPAMAGXPNM-UHFFFAOYSA-N
Mol Weight 447.6 g/mol
Molecular Formula C27H36F3NO
Exact Mass 447.274899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3TP3Tte8QM8
Name 3-(Trifluoromethyl) benzamide, N-(2-phenylethyl)-N-undecyl-
Comments Computed using HOSE algorithm
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Exact Mass 447.274899271 u
Formula C27H36F3NO
InChI InChI=1S/C27H36F3NO/c1-2-3-4-5-6-7-8-9-13-20-31(21-19-23-15-11-10-12-16-23)26(32)24-17-14-18-25(22-24)27(28,29)30/h10-12,14-18,22H,2-9,13,19-21H2,1H3
InChIKey SAIUMPAMAGXPNM-UHFFFAOYSA-N
Molecular Weight 447.586 g/mol
SMILES C1(=CC=CC=C1)CCN(C(=O)C1=CC(C(F)(F)F)=CC=C1)CCCCCCCCCCC