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

View entire compound with spectra: 1 NMR

Carbonic acid, monoamide, N-(2-pentyl)-N-octadecyl-, isobutyl ester
SpectraBase Compound ID FTj6A1c0WDS
InChI InChI=1S/C28H57NO2/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(27(5)23-7-2)28(30)31-25-26(3)4/h26-27H,6-25H2,1-5H3
InChIKey AHKWMLZAVLHKNZ-UHFFFAOYSA-N
Mol Weight 439.8 g/mol
Molecular Formula C28H57NO2
Exact Mass 439.43893 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26tfOSDkI2F
Name Carbonic acid, monoamide, N-(2-pentyl)-N-octadecyl-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 439.438930077 u
Formula C28H57NO2
InChI InChI=1S/C28H57NO2/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-29(27(5)23-7-2)28(30)31-25-26(3)4/h26-27H,6-25H2,1-5H3
InChIKey AHKWMLZAVLHKNZ-UHFFFAOYSA-N
Molecular Weight 439.769 g/mol
SMILES CCCC(C)N(C(OCC(C)C)=O)CCCCCCCCCCCCCCCCCC