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Carbonic acid, monoamide, N-(2-pentyl)-N-octadecyl-, benzyl ester

View entire compound with spectra: 1 NMR

Carbonic acid, monoamide, N-(2-pentyl)-N-octadecyl-, benzyl ester
SpectraBase Compound ID LBQDwm29wDp
InChI InChI=1S/C31H55NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-32(29(3)24-5-2)31(33)34-28-30-25-21-20-22-26-30/h20-22,25-26,29H,4-19,23-24,27-28H2,1-3H3
InChIKey ZRVQCOYFSCSIMM-UHFFFAOYSA-N
Mol Weight 473.8 g/mol
Molecular Formula C31H55NO2
Exact Mass 473.42328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6lXSL5sRlaT
Name Carbonic acid, monoamide, N-(2-pentyl)-N-octadecyl-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 473.423280013 u
Formula C31H55NO2
InChI InChI=1S/C31H55NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-27-32(29(3)24-5-2)31(33)34-28-30-25-21-20-22-26-30/h20-22,25-26,29H,4-19,23-24,27-28H2,1-3H3
InChIKey ZRVQCOYFSCSIMM-UHFFFAOYSA-N
Molecular Weight 473.786 g/mol
SMILES CCCC(C)N(C(OCC=1C=CC=CC1)=O)CCCCCCCCCCCCCCCCCC