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Pipecolylpipecolic acid, N-ethoxycarbonyl-, pentyl ester
SpectraBase Compound ID Jiw5ztztADQ
InChI InChI=1S/C20H34N2O5/c1-3-5-10-15-27-19(24)17-12-7-8-13-21(17)18(23)16-11-6-9-14-22(16)20(25)26-4-2/h16-17H,3-15H2,1-2H3
InChIKey XWZGEEUTMORDQU-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C20H34N2O5
Exact Mass 382.246772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKwM1O9K7Sp
Name Pipecolylpipecolic acid, N-ethoxycarbonyl-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 382.246772198 u
Formula C20H34N2O5
InChI InChI=1S/C20H34N2O5/c1-3-5-10-15-27-19(24)17-12-7-8-13-21(17)18(23)16-11-6-9-14-22(16)20(25)26-4-2/h16-17H,3-15H2,1-2H3
InChIKey XWZGEEUTMORDQU-UHFFFAOYSA-N
Molecular Weight 382.501 g/mol
SMILES C1CCN(C(C1)C(OCCCCC)=O)C(C1CCCCN1C(OCC)=O)=O