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

View entire compound with spectra: 1 NMR

Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, nonyl ester
SpectraBase Compound ID 4bw1rTc16vP
InChI InChI=1S/C22H37NO4/c1-3-5-7-8-9-10-14-18-26-21(24)20(19-15-12-11-13-16-19)23-22(25)27-17-6-4-2/h2,19-20H,3,5-18H2,1H3,(H,23,25)
InChIKey JSKRNHJXIGRWIW-UHFFFAOYSA-N
Mol Weight 379.5 g/mol
Molecular Formula C22H37NO4
Exact Mass 379.272259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2EgrxrEAr2z
Name Glycine, 2-cyclohexyl-N-(but-3-yn-1-yl)oxycarbonyl-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 379.272258671 u
Formula C22H37NO4
InChI InChI=1S/C22H37NO4/c1-3-5-7-8-9-10-14-18-26-21(24)20(19-15-12-11-13-16-19)23-22(25)27-17-6-4-2/h2,19-20H,3,5-18H2,1H3,(H,23,25)
InChIKey JSKRNHJXIGRWIW-UHFFFAOYSA-N
Molecular Weight 379.541 g/mol
SMILES C1CC(CCC1)C(NC(=O)OCCC#C)C(OCCCCCCCCC)=O