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L-Proline, N-butoxycarbonyl-, octadecyl ester

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L-Proline, N-butoxycarbonyl-, octadecyl ester
SpectraBase Compound ID 80LORykIzRu
InChI InChI=1S/C28H53NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-32-27(30)26-22-21-23-29(26)28(31)33-24-6-4-2/h26H,3-25H2,1-2H3
InChIKey RJHVLUYRZBKNOG-UHFFFAOYSA-N
Mol Weight 467.7 g/mol
Molecular Formula C28H53NO4
Exact Mass 467.397459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DnS37Cy9mxX
Name L-Proline, N-butoxycarbonyl-, octadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 467.397459187 u
Formula C28H53NO4
InChI InChI=1S/C28H53NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-32-27(30)26-22-21-23-29(26)28(31)33-24-6-4-2/h26H,3-25H2,1-2H3
InChIKey RJHVLUYRZBKNOG-UHFFFAOYSA-N
Molecular Weight 467.735 g/mol
SMILES C1(N(CCC1)C(=O)OCCCC)C(OCCCCCCCCCCCCCCCCCC)=O