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Pipecolylpipecolic acid, N-ethoxycarbonyl-, dodecyl ester

View entire compound with spectra: 1 NMR

Pipecolylpipecolic acid, N-ethoxycarbonyl-, dodecyl ester
SpectraBase Compound ID LPhDNTPT1Vh
InChI InChI=1S/C27H48N2O5/c1-3-5-6-7-8-9-10-11-12-17-22-34-26(31)24-19-14-15-20-28(24)25(30)23-18-13-16-21-29(23)27(32)33-4-2/h23-24H,3-22H2,1-2H3
InChIKey OMDXZYXGABCENJ-UHFFFAOYSA-N
Mol Weight 480.7 g/mol
Molecular Formula C27H48N2O5
Exact Mass 480.356323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtyE8NKEKii
Name Pipecolylpipecolic acid, N-ethoxycarbonyl-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 480.356322649 u
Formula C27H48N2O5
InChI InChI=1S/C27H48N2O5/c1-3-5-6-7-8-9-10-11-12-17-22-34-26(31)24-19-14-15-20-28(24)25(30)23-18-13-16-21-29(23)27(32)33-4-2/h23-24H,3-22H2,1-2H3
InChIKey OMDXZYXGABCENJ-UHFFFAOYSA-N
Molecular Weight 480.690 g/mol
SMILES C1CCN(C(C1)C(OCCCCCCCCCCCC)=O)C(C1CCCCN1C(OCC)=O)=O