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Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, undecyl ester

View entire compound with spectra: 1 NMR

Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, undecyl ester
SpectraBase Compound ID JralDV8cCNS
InChI InChI=1S/C24H41NO4/c1-3-5-7-8-9-10-11-12-16-20-28-23(26)22(21-17-14-13-15-18-21)25-24(27)29-19-6-4-2/h2,21-22H,3,5-20H2,1H3,(H,25,27)
InChIKey SKCABHVURBQMBX-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C24H41NO4
Exact Mass 407.303559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7FV25C97a9I
Name Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 407.303558800 u
Formula C24H41NO4
InChI InChI=1S/C24H41NO4/c1-3-5-7-8-9-10-11-12-16-20-28-23(26)22(21-17-14-13-15-18-21)25-24(27)29-19-6-4-2/h2,21-22H,3,5-20H2,1H3,(H,25,27)
InChIKey SKCABHVURBQMBX-UHFFFAOYSA-N
Molecular Weight 407.595 g/mol
SMILES C1CC(CCC1)C(NC(=O)OCCC#C)C(OCCCCCCCCCCC)=O