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Pipecolylpipecolic acid, N-isobutoxycarbonyl-, isobutyl ester

View entire compound with spectra: 1 NMR

Pipecolylpipecolic acid, N-isobutoxycarbonyl-, isobutyl ester
SpectraBase Compound ID AIeryO9J8I6
InChI InChI=1S/C21H36N2O5/c1-15(2)13-27-20(25)18-10-6-7-11-22(18)19(24)17-9-5-8-12-23(17)21(26)28-14-16(3)4/h15-18H,5-14H2,1-4H3
InChIKey RYOKFHBWCNJNCA-UHFFFAOYSA-N
Mol Weight 396.5 g/mol
Molecular Formula C21H36N2O5
Exact Mass 396.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FvsM2MueOsf
Name Pipecolylpipecolic acid, N-isobutoxycarbonyl-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 396.262422262 u
Formula C21H36N2O5
InChI InChI=1S/C21H36N2O5/c1-15(2)13-27-20(25)18-10-6-7-11-22(18)19(24)17-9-5-8-12-23(17)21(26)28-14-16(3)4/h15-18H,5-14H2,1-4H3
InChIKey RYOKFHBWCNJNCA-UHFFFAOYSA-N
Molecular Weight 396.528 g/mol
SMILES C1CCN(C(C1)C(OCC(C)C)=O)C(=O)C1N(CCCC1)C(=O)OCC(C)C