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1-(2-CARBOXYETHYL)-4-PICOLYL-1,4,7,10-TETRAAZACYCLODODECANE

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1-(2-CARBOXYETHYL)-4-PICOLYL-1,4,7,10-TETRAAZACYCLODODECANE
SpectraBase Compound ID A2Dbjw5WmTC
InChI InChI=1S/C17H29N5O2/c23-17(24)4-10-21-11-8-18-6-7-19-9-12-22(14-13-21)15-16-3-1-2-5-20-16/h1-3,5,18-19H,4,6-15H2,(H,23,24)
InChIKey GGTWBHQLQCBUFH-UHFFFAOYSA-N
Mol Weight 335.45 g/mol
Molecular Formula C17H29N5O2
Exact Mass 335.232125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iTeVyZGIOG
Name 1-(2-CARBOXYETHYL)-4-PICOLYL-1,4,7,10-TETRAAZACYCLODODECANE
Compound Number 9B''
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H29N5O2
InChI InChI=1S/C17H29N5O2/c23-17(24)4-10-21-11-8-18-6-7-19-9-12-22(14-13-21)15-16-3-1-2-5-20-16/h1-3,5,18-19H,4,6-15H2,(H,23,24)
InChIKey GGTWBHQLQCBUFH-UHFFFAOYSA-N
Literature Reference Author F.BELLOUARD,F.CHUBURU,N.KERVAREC,L.TOUPET,S.TRIKI,Y.L.MEST,H .HANDEL
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3499(1999)
Literature Reference DOI 10.1039/a905701c
Molecular Weight 335.450 g/mol
Solvent D2O
Source File Reference UWKP2568