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Sarcosine, N-pentafluorobenzoyl-, pentadecyl ester

View entire compound with spectra: 1 NMR

Sarcosine, N-pentafluorobenzoyl-, pentadecyl ester
SpectraBase Compound ID 2mHgYqA6zyq
InChI InChI=1S/C25H36F5NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-34-18(32)17-31(2)25(33)19-20(26)22(28)24(30)23(29)21(19)27/h3-17H2,1-2H3
InChIKey CEOWCCZAKHOTFS-UHFFFAOYSA-N
Mol Weight 493.6 g/mol
Molecular Formula C25H36F5NO3
Exact Mass 493.261535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10pP0Q4CAuz
Name Sarcosine, N-pentafluorobenzoyl-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 493.261534835 u
Formula C25H36F5NO3
InChI InChI=1S/C25H36F5NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-34-18(32)17-31(2)25(33)19-20(26)22(28)24(30)23(29)21(19)27/h3-17H2,1-2H3
InChIKey CEOWCCZAKHOTFS-UHFFFAOYSA-N
Molecular Weight 493.559 g/mol
SMILES C(CCCCCOC(CN(C(=O)C1=C(C(=C(C(=C1F)F)F)F)F)C)=O)CCCCCCCCC