For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-METHYLENE-(PARA-NITROPHENOL)-1,4,7,10-TETRAAZACYCLODODECANE-4,7,10-TRIACETAMIDE;NP-DO3AM
SpectraBase Compound ID 8CmeR1nEWDx
InChI InChI=1S/C21H34N8O6/c22-19(31)13-26-5-3-25(12-16-11-17(29(34)35)1-2-18(16)30)4-6-27(14-20(23)32)8-10-28(9-7-26)15-21(24)33/h1-2,11,30H,3-10,12-15H2,(H2,22,31)(H2,23,32)(H2,24,33)
InChIKey MWWSBSXHZKAZCH-UHFFFAOYSA-N
Mol Weight 494.6 g/mol
Molecular Formula C21H34N8O6
Exact Mass 494.260131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JjKsnIOgcJV
Name 1-METHYLENE-(PARA-NITROPHENOL)-1,4,7,10-TETRAAZACYCLODODECANE-4,7,10-TRIACETAMIDE;NP-DO3AM
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34N8O6
InChI InChI=1S/C21H34N8O6/c22-19(31)13-26-5-3-25(12-16-11-17(29(34)35)1-2-18(16)30)4-6-27(14-20(23)32)8-10-28(9-7-26)15-21(24)33/h1-2,11,30H,3-10,12-15H2,(H2,22,31)(H2,23,32)(H2,24,33)
InChIKey MWWSBSXHZKAZCH-UHFFFAOYSA-N
Literature Reference Author M.WOODS,G.E.KIEFER,S.BOTT,A.CASTILLO-MUZQUIZ,C.ESHELBRENNER, L.MICHAUDET,K.MCMILL
Literature Reference Citation J.AM.CHEM.SOC.,126,9248(2004)
Literature Reference DOI 10.1021/ja048299z
Molecular Weight 494.551 g/mol
Solvent CDCl3
Source File Reference UWMZ24365