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VPMREYNFHOGGLG-MJCKVQKWSA-J

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VPMREYNFHOGGLG-MJCKVQKWSA-J
SpectraBase Compound ID 24scGOXgt63
InChI InChI=1S/C16H12N4O9S2.4Na/c21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29;;;;/h1-8,21H,(H,22,23)(H,24,25,26)(H,27,28,29);;;;/q;4*+1/p-4/b18-17+;;;;
InChIKey VPMREYNFHOGGLG-MJCKVQKWSA-J
Mol Weight 556.33807713 g/mol
Molecular Formula C16H8N4Na4O9S2
Exact Mass 555.932347 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LlS66fePAr2
Name VPMREYNFHOGGLG-MJCKVQKWSA-J
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H8N4Na4O9S2
InChI InChI=1S/C16H12N4O9S2.4Na/c21-15-13(18-17-9-1-5-11(6-2-9)30(24,25)26)14(16(22)23)19-20(15)10-3-7-12(8-4-10)31(27,28)29;;;;/h1-8,21H,(H,22,23)(H,24,25,26)(H,27,28,29);;;;/q;4*+1/p-4/b18-17+;;;;
InChIKey VPMREYNFHOGGLG-MJCKVQKWSA-J
Literature Reference Author E.R.MAZZOLA,S.J.BELL,S.A.TURUJMAN,J.N.BARROWS,J.E.BAILEY,J.B .MCMAHON,T.K.GERMANN
Literature Reference Citation CAN.J.CHEM.,77,1941(1999)
Literature Reference DOI 10.1139/cjc-77-11-1941
Solvent D2O;PH=12
Source File Reference UWSI527