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2-ACETONYL-5-NITRO-5-PHENYLAZO-4,6-2,5-DIHYDROPYRIMIDINE
SpectraBase Compound ID ACJh68NZQMC
InChI InChI=1S/2C15H17N5O5/c2*1-10(21)9-12-16-13(24-2)15(20(22)23,14(17-12)25-3)19-18-11-7-5-4-6-8-11/h2*4-8,12H,9H2,1-3H3/b2*19-18+
InChIKey LBBBOAVYDIQCDC-VBASXBQTSA-N
Mol Weight 694.66 g/mol
Molecular Formula C30H34N10O10
Exact Mass 694.245937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID oLUSvXEZgq
Name 2-ACETONYL-5-NITRO-5-PHENYLAZO-4,6-2,5-DIHYDROPYRIMIDINE
Compound Number III-C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34N10O10
InChI InChI=1S/2C15H17N5O5/c2*1-10(21)9-12-16-13(24-2)15(20(22)23,14(17-12)25-3)19-18-11-7-5-4-6-8-11/h2*4-8,12H,9H2,1-3H3/b2*19-18+
InChIKey LBBBOAVYDIQCDC-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 694.661 g/mol
Solvent CDCl3
Source File Reference UWMZ12462