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2-ACETONYL-5-NITRO-5-(2-NITROPHENYLAZO)-4,6-2,5-DIHYDROPYRIMIDINE
SpectraBase Compound ID AjUMPaclEqh
InChI InChI=1S/2C15H16N6O7/c2*1-9(22)8-12-16-13(27-2)15(21(25)26,14(17-12)28-3)19-18-10-6-4-5-7-11(10)20(23)24/h2*4-7,12H,8H2,1-3H3/b2*19-18+
InChIKey NUMFTOWRIOUIJE-VBASXBQTSA-N
Mol Weight 784.66 g/mol
Molecular Formula C30H32N12O14
Exact Mass 784.216094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FuDOJMxnoVH
Name 2-ACETONYL-5-NITRO-5-(2-NITROPHENYLAZO)-4,6-2,5-DIHYDROPYRIMIDINE
Compound Number III-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32N12O14
InChI InChI=1S/2C15H16N6O7/c2*1-9(22)8-12-16-13(27-2)15(21(25)26,14(17-12)28-3)19-18-10-6-4-5-7-11(10)20(23)24/h2*4-7,12H,8H2,1-3H3/b2*19-18+
InChIKey NUMFTOWRIOUIJE-VBASXBQTSA-N
Literature Reference Author G.Y.REMENNIKIV,S.G.VISHNEVSKII,V.V.PIROZHENKO,S.I.VDOVENKO,V .M.CHERKASOV,D.S.YUF
Literature Reference Citation CHEM.HET.COMP.,29,186(1993)
Literature Reference DOI 10.1007/bf00531663
Molecular Weight 784.656 g/mol
Solvent CDCl3
Source File Reference UWMZ12460