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5-(META-NITROPHENYL)-AZO-2-THIOXO-PYRIMIDINE-(1H,3H,5H)-4,6-DIONE;LACTIM-AZO
SpectraBase Compound ID JJN309C0j6a
InChI InChI=1S/C10H7N5O4S/c16-8-7(9(17)12-10(20)11-8)14-13-5-2-1-3-6(4-5)15(18)19/h1-4H,(H3,11,12,16,17,20)/b14-13+
InChIKey XQAPKDOGJZTPQJ-BUHFOSPRSA-N
Mol Weight 293.26 g/mol
Molecular Formula C10H7N5O4S
Exact Mass 293.021875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bebys801mqR
Name 5-(META-NITROPHENYL)-AZO-2-THIOXO-PYRIMIDINE-(1H,3H,5H)-4,6-DIONE;LACTIM-AZO
Compound Number 7B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H7N5O4S
InChI InChI=1S/C10H7N5O4S/c16-8-7(9(17)12-10(20)11-8)14-13-5-2-1-3-6(4-5)15(18)19/h1-4H,(H3,11,12,16,17,20)/b14-13+
InChIKey XQAPKDOGJZTPQJ-BUHFOSPRSA-N
Literature Reference Author N.N.PESYAN
Literature Reference Citation MAGN.RES.CHEM.,47,953(2009)
Literature Reference DOI 10.1002/mrc.2498
Molecular Weight 293.257 g/mol
Solvent DMSO-D6
Source File Reference UWLU80171