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2-Methyl-1,4-diphenylbutane-1,4-dione

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2-Methyl-1,4-diphenylbutane-1,4-dione
SpectraBase Compound ID FbkSMJpH5yJ
InChI InChI=1S/C17H16O2/c1-13(17(19)15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey NZKWSTSDWYNHNS-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6QgSo2uNhKb
Name 2-METHYL-1,4-DIPHENYLBUTANE-1,4-DIONE
Compound Number 3AG
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16O2
InChI InChI=1S/C17H16O2/c1-13(17(19)15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2-11,13H,12H2,1H3
InChIKey NZKWSTSDWYNHNS-UHFFFAOYSA-N
Literature Reference Author M.YASUDA,S.TSUJI,Y.SHIGEYOSHI,A.BABA
Literature Reference Citation J.AM.CHEM.SOC.,124,7440(2002)
Literature Reference DOI 10.1021/ja0258172
Molecular Weight 252.313 g/mol
Sample ID 34196
Solvent CDCl3