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Sarcosylsarcosine, N-heptafluorobutyryl-, undecyl ester

View entire compound with spectra: 1 NMR

Sarcosylsarcosine, N-heptafluorobutyryl-, undecyl ester
SpectraBase Compound ID 9mJlO280njC
InChI InChI=1S/C21H33F7N2O4/c1-4-5-6-7-8-9-10-11-12-13-34-17(32)15-29(2)16(31)14-30(3)18(33)19(22,23)20(24,25)21(26,27)28/h4-15H2,1-3H3
InChIKey XSKDZIVRHUUGQQ-UHFFFAOYSA-N
Mol Weight 510.5 g/mol
Molecular Formula C21H33F7N2O4
Exact Mass 510.232855 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hz5nfi4mA6n
Name Sarcosylsarcosine, N-heptafluorobutyryl-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 510.232854688 u
Formula C21H33F7N2O4
InChI InChI=1S/C21H33F7N2O4/c1-4-5-6-7-8-9-10-11-12-13-34-17(32)15-29(2)16(31)14-30(3)18(33)19(22,23)20(24,25)21(26,27)28/h4-15H2,1-3H3
InChIKey XSKDZIVRHUUGQQ-UHFFFAOYSA-N
Molecular Weight 510.494 g/mol
SMILES C(OC(CN(C(CN(C(C(C(C(F)(F)F)(F)F)(F)F)=O)C)=O)C)=O)CCCCCCCCCC