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Carbonic acid, monoamide, N-(2-phenylethyl)-N-undecyl-, octyl ester
SpectraBase Compound ID KvJSKiwFmXz
InChI InChI=1S/C28H49NO2/c1-3-5-7-9-11-12-13-14-19-24-29(25-23-27-21-17-16-18-22-27)28(30)31-26-20-15-10-8-6-4-2/h16-18,21-22H,3-15,19-20,23-26H2,1-2H3
InChIKey NVAISILPFBLAIZ-UHFFFAOYSA-N
Mol Weight 431.7 g/mol
Molecular Formula C28H49NO2
Exact Mass 431.37633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6R9BBlqfWoX
Name Carbonic acid, monoamide, N-(2-phenylethyl)-N-undecyl-, octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 431.376329820 u
Formula C28H49NO2
InChI InChI=1S/C28H49NO2/c1-3-5-7-9-11-12-13-14-19-24-29(25-23-27-21-17-16-18-22-27)28(30)31-26-20-15-10-8-6-4-2/h16-18,21-22H,3-15,19-20,23-26H2,1-2H3
InChIKey NVAISILPFBLAIZ-UHFFFAOYSA-N
Molecular Weight 431.705 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)OCCCCCCCC)CCCCCCCCCCC