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

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Carbonic acid, monoamide, N-propyl-N-octadecyl-, benzyl ester
SpectraBase Compound ID 4gi4hP1Ig5B
InChI InChI=1S/C29H51NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-30(25-4-2)29(31)32-27-28-23-20-19-21-24-28/h19-21,23-24H,3-18,22,25-27H2,1-2H3
InChIKey LWHJDGSXGKSTOL-UHFFFAOYSA-N
Mol Weight 445.7 g/mol
Molecular Formula C29H51NO2
Exact Mass 445.39198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EIifsUjrvE5
Name Carbonic acid, monoamide, N-propyl-N-octadecyl-, benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 445.391979884 u
Formula C29H51NO2
InChI InChI=1S/C29H51NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-26-30(25-4-2)29(31)32-27-28-23-20-19-21-24-28/h19-21,23-24H,3-18,22,25-27H2,1-2H3
InChIKey LWHJDGSXGKSTOL-UHFFFAOYSA-N
Molecular Weight 445.732 g/mol
SMILES C(N(CCC)CCCCCCCCCCCCCCCCCC)(=O)OCC=1C=CC=CC1