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Sarcosine, N-(2,6-difluorobenzoyl)-, pentadecyl ester

View entire compound with spectra: 1 NMR

Sarcosine, N-(2,6-difluorobenzoyl)-, pentadecyl ester
SpectraBase Compound ID nbpf7jVeWg
InChI InChI=1S/C25H39F2NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-31-23(29)20-28(2)25(30)24-21(26)17-16-18-22(24)27/h16-18H,3-15,19-20H2,1-2H3
InChIKey SDTQVJRLDZFWHF-UHFFFAOYSA-N
Mol Weight 439.6 g/mol
Molecular Formula C25H39F2NO3
Exact Mass 439.2898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CQihgrH5YqK
Name Sarcosine, N-(2,6-difluorobenzoyl)-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 439.289800443 u
Formula C25H39F2NO3
InChI InChI=1S/C25H39F2NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-31-23(29)20-28(2)25(30)24-21(26)17-16-18-22(24)27/h16-18H,3-15,19-20H2,1-2H3
InChIKey SDTQVJRLDZFWHF-UHFFFAOYSA-N
Molecular Weight 439.588 g/mol
SMILES C1(=CC=CC(=C1C(N(CC(OCCCCCCCCCCCCCCC)=O)C)=O)F)F