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3,7-bis(benzyl)-9-keto-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID wmwRzEZISv
InChI InChI=1S/C25H28N2O5/c1-31-22(29)24-15-26(13-19-9-5-3-6-10-19)17-25(21(24)28,23(30)32-2)18-27(16-24)14-20-11-7-4-8-12-20/h3-12H,13-18H2,1-2H3/t24-,25+
InChIKey ZKHGINIQEBQNLM-PLQXJYEYSA-N
Mol Weight 436.51 g/mol
Molecular Formula C25H28N2O5
Exact Mass 436.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3FLY9hjOqmU
Name 3,7-bis(benzyl)-9-keto-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid dimethyl ester
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28N2O5
InChI InChI=1S/C25H28N2O5/c1-31-22(29)24-15-26(13-19-9-5-3-6-10-19)17-25(21(24)28,23(30)32-2)18-27(16-24)14-20-11-7-4-8-12-20/h3-12H,13-18H2,1-2H3/t24-,25+
InChIKey ZKHGINIQEBQNLM-PLQXJYEYSA-N
Literature Reference Author A.GOGOLL,H.GRENNBERG,A.AXEN
Literature Reference Citation MAGN.RES.CHEM.,35,13(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199701)35:1<13::aid-omr27>3.0.co;2-m
Molecular Weight 436.508 g/mol
Solvent CDCl3
Source File Reference UWCP4536