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ABTS;2,2'-AZINO-DI-(3-ETHYLBENZOTHIAZOLINE-6-SULFONIC-ACID)-DIAMONIUM-SALT

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ABTS;2,2'-AZINO-DI-(3-ETHYLBENZOTHIAZOLINE-6-SULFONIC-ACID)-DIAMONIUM-SALT
SpectraBase Compound ID Gm2Otg3eJRP
InChI InChI=1S/C18H18N4O6S4.2N/c1-3-21-13-7-5-11(31(23,24)25)9-15(13)29-17(21)19-20-18-22(4-2)14-8-6-12(32(26,27)28)10-16(14)30-18;;/h5-10H,3-4H2,1-2H3,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/b19-17-,20-18+;;
InChIKey BKOXYSDXWVNHJP-IILAXKDUSA-L
Mol Weight 540.602 g/mol
Molecular Formula C18H16N6O6S4
Exact Mass 540.001417 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 16znLkBVxA2
Name ABTS;2,2'-AZINO-DI-(3-ETHYLBENZOTHIAZOLINE-6-SULFONIC-ACID)-DIAMONIUM-SALT
Compound Number V
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16N6O6S4
InChI InChI=1S/C18H18N4O6S4.2N/c1-3-21-13-7-5-11(31(23,24)25)9-15(13)29-17(21)19-20-18-22(4-2)14-8-6-12(32(26,27)28)10-16(14)30-18;;/h5-10H,3-4H2,1-2H3,(H,23,24,25)(H,26,27,28);;/q;2*+1/p-2/b19-17-,20-18+;;
InChIKey BKOXYSDXWVNHJP-IILAXKDUSA-L
Literature Reference Author A.NUMATA,G.R.PETTIT,M.NABAE,K.YAMAMOTO,E.YAMAMOTO,E.MATSUMUR A,T.KAWANO
Literature Reference Citation AGR.BIOL.CHEM.,51,1199(1987)
Literature Reference DOI 10.1271/bbb1961.51.1199
Molecular Weight 540.602 g/mol
Solvent DMSO-D6
Source File Reference UWBT8133