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Sarcosine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester

View entire compound with spectra: 1 NMR

Sarcosine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
SpectraBase Compound ID IdDdYsskE4F
InChI InChI=1S/C25H38F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-32-23(30)20-29(2)24(31)21-17-14-15-18-22(21)25(26,27)28/h14-15,17-18H,3-13,16,19-20H2,1-2H3
InChIKey ILZAMXCFJAJNMX-UHFFFAOYSA-N
Mol Weight 457.6 g/mol
Molecular Formula C25H38F3NO3
Exact Mass 457.280379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3MgGckFDnXN
Name Sarcosine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 457.280378574 u
Formula C25H38F3NO3
InChI InChI=1S/C25H38F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-32-23(30)20-29(2)24(31)21-17-14-15-18-22(21)25(26,27)28/h14-15,17-18H,3-13,16,19-20H2,1-2H3
InChIKey ILZAMXCFJAJNMX-UHFFFAOYSA-N
Molecular Weight 457.578 g/mol
SMILES C1(=CC=CC=C1C(N(CC(OCCCCCCCCCCCCCC)=O)C)=O)C(F)(F)F