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Glycine, N-(2-trifluoromethylbenzoyl)-, tridecyl ester

View entire compound with spectra: 1 NMR

Glycine, N-(2-trifluoromethylbenzoyl)-, tridecyl ester
SpectraBase Compound ID GT4lZI9VLVM
InChI InChI=1S/C23H34F3NO3/c1-2-3-4-5-6-7-8-9-10-11-14-17-30-21(28)18-27-22(29)19-15-12-13-16-20(19)23(24,25)26/h12-13,15-16H,2-11,14,17-18H2,1H3,(H,27,29)
InChIKey JWWISKXKRPDKDI-UHFFFAOYSA-N
Mol Weight 429.5 g/mol
Molecular Formula C23H34F3NO3
Exact Mass 429.249078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GE20Zz6K2UE
Name Glycine, N-(2-trifluoromethylbenzoyl)-, tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 429.249078445 u
Formula C23H34F3NO3
InChI InChI=1S/C23H34F3NO3/c1-2-3-4-5-6-7-8-9-10-11-14-17-30-21(28)18-27-22(29)19-15-12-13-16-20(19)23(24,25)26/h12-13,15-16H,2-11,14,17-18H2,1H3,(H,27,29)
InChIKey JWWISKXKRPDKDI-UHFFFAOYSA-N
Molecular Weight 429.524 g/mol
SMILES C1(=CC=CC=C1C(NCC(OCCCCCCCCCCCCC)=O)=O)C(F)(F)F