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(4E)-4-hydroxy-1,6-dimesityl-4-hexene-1,3,6-trione
SpectraBase Compound ID 5hCRM8STvv4
InChI InChI=1S/C24H26O4/c1-13-7-15(3)23(16(4)8-13)21(27)11-19(25)20(26)12-22(28)24-17(5)9-14(2)10-18(24)6/h7-11,25H,12H2,1-6H3/b19-11+
InChIKey DVPZRVYSVLIFDK-YBFXNURJSA-N
Mol Weight 378.47 g/mol
Molecular Formula C24H26O4
Exact Mass 378.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HBDquStIHRr
Name (4E)-4-Hydroxy-1,6-dimesityl-4-hexene-1,3,6-trione
Comments Computed using HOSE algorithm
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Exact Mass 378.183109313 u
Formula C24H26O4
InChI InChI=1S/C24H26O4/c1-13-7-15(3)23(16(4)8-13)21(27)11-19(25)20(26)12-22(28)24-17(5)9-14(2)10-18(24)6/h7-11,25H,12H2,1-6H3/b19-11+
InChIKey DVPZRVYSVLIFDK-YBFXNURJSA-N
Molecular Weight 378.468 g/mol
SMILES O\C(=C\C(C1=C(C=C(C=C1C)C)C)=O)C(CC(C1=C(C=C(C=C1C)C)C)=O)=O