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2,6-diketo-4-[(1R,2S,3S)-1,2,3,4-tetrakis(benzyloxy)butyl]nipecotic acid tert-butyl ester
SpectraBase Compound ID Lbf9IqK9jRB
InChI InChI=1S/C42H47NO8/c1-42(2,3)51-41(46)37-34(24-36(44)43-40(37)45)38(49-27-32-20-12-6-13-21-32)39(50-28-33-22-14-7-15-23-33)35(48-26-31-18-10-5-11-19-31)29-47-25-30-16-8-4-9-17-30/h4-23,34-35,37-39H,24-29H2,1-3H3,(H,43,44,45)/t34?,35-,37?,38+,39+/m0/s1
InChIKey ATIZHXQUOYPBJB-OCPXPRSASA-N
Mol Weight 693.8 g/mol
Molecular Formula C42H47NO8
Exact Mass 693.330167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ApEz1gnZO1L
Name 2,6-diketo-4-[(1R,2S,3S)-1,2,3,4-tetrakis(benzyloxy)butyl]nipecotic acid tert-butyl ester
Compound Number B6*
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H47NO8
InChI InChI=1S/C42H47NO8/c1-42(2,3)51-41(46)37-34(24-36(44)43-40(37)45)38(49-27-32-20-12-6-13-21-32)39(50-28-33-22-14-7-15-23-33)35(48-26-31-18-10-5-11-19-31)29-47-25-30-16-8-4-9-17-30/h4-23,34-35,37-39H,24-29H2,1-3H3,(H,43,44,45)/t34?,35-,37?,38+,39+/m0/s1
InChIKey ATIZHXQUOYPBJB-OCPXPRSASA-N
Literature Reference Author H.M.PARK,D.M.PIATAK,J.R.PETERSON,A.M.CLARK
Literature Reference Citation CAN.J.CHEM.,70,1662(1992)
Literature Reference DOI 10.1139/v92-208
Molecular Weight 693.837 g/mol
Solvent DMSO-D6
Source File Reference UWVP4727