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4-METHYL-4-NITRO-1-PHENYLPENTANE-1,2-DIONE
SpectraBase Compound ID 9UHiiKEd2Pn
InChI InChI=1S/C12H13NO4/c1-12(2,13(16)17)8-10(14)11(15)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey GLJGDFZWZQHXIL-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D800pR8pRJh
Name 4-METHYL-4-NITRO-1-PHENYLPENTANE-1,2-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-12(2,13(16)17)8-10(14)11(15)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKey GLJGDFZWZQHXIL-UHFFFAOYSA-N
Literature Reference Author D.S.C.BLACK,G.D.FALLON,B.M.GATEHOUSE,J.D.WISHART
Literature Reference Citation AUSTR.J.CHEM.,37,777(1984)
Literature Reference DOI 10.1071/ch9840777
Molecular Weight 235.240 g/mol
Solvent CDCl3
Source File Reference UWWR1041