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12-[(TERT.-BUTOXYCARBONYL)-AMINO]-9-TOSYL-4,9-DIAZADODECANITRILE
SpectraBase Compound ID 37vPj3SwOtn
InChI InChI=1S/C22H36N4O4S/c1-19-9-11-20(12-10-19)31(28,29)26(17-6-5-14-24-15-7-13-23)18-8-16-25-21(27)30-22(2,3)4/h9-12,24H,5-8,14-18H2,1-4H3,(H,25,27)
InChIKey BXUUSXRKLBWSAM-UHFFFAOYSA-N
Mol Weight 452.6 g/mol
Molecular Formula C22H36N4O4S
Exact Mass 452.245727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJU61QdFyIF
Name 12-[(TERT.-BUTOXYCARBONYL)-AMINO]-9-TOSYL-4,9-DIAZADODECANITRILE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36N4O4S
InChI InChI=1S/C22H36N4O4S/c1-19-9-11-20(12-10-19)31(28,29)26(17-6-5-14-24-15-7-13-23)18-8-16-25-21(27)30-22(2,3)4/h9-12,24H,5-8,14-18H2,1-4H3,(H,25,27)
InChIKey BXUUSXRKLBWSAM-UHFFFAOYSA-N
Literature Reference Author W.J.FIEDLER,M.HESSE
Literature Reference Citation HELV.CHIM.ACTA,76,1511(1993)
Literature Reference DOI 10.1002/hlca.19930760412
Molecular Weight 452.612 g/mol
Solvent CDCl3
Source File Reference UWRK1916