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Carbonic acid, monoamide, N-benzyl-N-octadecyl-, propargyl ester

View entire compound with spectra: 1 NMR

Carbonic acid, monoamide, N-benzyl-N-octadecyl-, propargyl ester
SpectraBase Compound ID 2xsengLIweE
InChI InChI=1S/C29H47NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-30(29(31)32-26-4-2)27-28-23-20-19-21-24-28/h2,19-21,23-24H,3,5-18,22,25-27H2,1H3
InChIKey YVTFRZKSEFADQC-UHFFFAOYSA-N
Mol Weight 441.7 g/mol
Molecular Formula C29H47NO2
Exact Mass 441.36068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B0cJxlAdJIA
Name Carbonic acid, monoamide, N-benzyl-N-octadecyl-, propargyl ester
Comments Computed using HOSE algorithm
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Exact Mass 441.360679755 u
Formula C29H47NO2
InChI InChI=1S/C29H47NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-30(29(31)32-26-4-2)27-28-23-20-19-21-24-28/h2,19-21,23-24H,3,5-18,22,25-27H2,1H3
InChIKey YVTFRZKSEFADQC-UHFFFAOYSA-N
Molecular Weight 441.700 g/mol
SMILES C(N(CCCCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)OCC#C