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1,4-BIS-(2-CARBOXYETHYL)-1,4,8,11-TETRAAZACYCLOTETRADECANE-TETRAHYDROCHLORIDE

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1,4-BIS-(2-CARBOXYETHYL)-1,4,8,11-TETRAAZACYCLOTETRADECANE-TETRAHYDROCHLORIDE
SpectraBase Compound ID JhDIoNYrPyr
InChI InChI=1S/C16H32N4O4.4ClH/c21-15(22)3-11-19-9-1-5-17-7-8-18-6-2-10-20(14-13-19)12-4-16(23)24;;;;/h17-18H,1-14H2,(H,21,22)(H,23,24);4*1H
InChIKey BKEWLIDJOPDLRU-UHFFFAOYSA-N
Mol Weight 490.3 g/mol
Molecular Formula C16H36Cl4N4O4
Exact Mass 488.149066 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HlEKHibyFcq
Name 1,4-BIS-(2-CARBOXYETHYL)-1,4,8,11-TETRAAZACYCLOTETRADECANE-TETRAHYDROCHLORIDE
Compound Number 8A'
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H36Cl4N4O4
InChI InChI=1S/C16H32N4O4.4ClH/c21-15(22)3-11-19-9-1-5-17-7-8-18-6-2-10-20(14-13-19)12-4-16(23)24;;;;/h17-18H,1-14H2,(H,21,22)(H,23,24);4*1H
InChIKey BKEWLIDJOPDLRU-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 490.298 g/mol
Solvent D2O
Source File Reference UWKP2562