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Pipecolic acid, N-octyloxycarbonyl-, tridecyl ester

View entire compound with spectra: 1 NMR

Pipecolic acid, N-octyloxycarbonyl-, tridecyl ester
SpectraBase Compound ID F2Td3S51FM4
InChI InChI=1S/C28H53NO4/c1-3-5-7-9-11-12-13-14-15-17-20-24-32-27(30)26-22-18-19-23-29(26)28(31)33-25-21-16-10-8-6-4-2/h26H,3-25H2,1-2H3
InChIKey NLQRDKQDVRYRRO-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 3IxEzutr5bx
Name Pipecolic acid, N-octyloxycarbonyl-, tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 467.397459187 u
Formula C28H53NO4
InChI InChI=1S/C28H53NO4/c1-3-5-7-9-11-12-13-14-15-17-20-24-32-27(30)26-22-18-19-23-29(26)28(31)33-25-21-16-10-8-6-4-2/h26H,3-25H2,1-2H3
InChIKey NLQRDKQDVRYRRO-UHFFFAOYSA-N
Molecular Weight 467.735 g/mol
SMILES C1CCN(C(C1)C(OCCCCCCCCCCCCC)=O)C(OCCCCCCCC)=O