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7,7-dimethyloctan-1-one; 2,2-dimethylpropan-1-ol; hydrogen peroxide; oxidanylidenetitanium; prop-1-ene
7,7-dimethyloctan-1-one; 2,2-dimethylpropan-1-ol; hydrogen peroxide; oxidanylidenetitanium; prop-1-ene
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Canonical SMILES:
CC(C)(C)CCCCC[C-]=O.CC(C)(C)CCCCC[C-]=O.CC(C)(C)CCCCC[C-]=O.CC(C)(C)CO.[CH2-]C=C.[CH2-]C=C.OO.O=[Ti]
Isomeric SMILES
CC(C)(C)CCCCC[C-]=O.CC(C)(C)CCCCC[C-]=O.CC(C)(C)CCCCC[C-]=O.CC(C)(C)CO.[CH2-]C=C.[CH2-]C=C.OO.O=[Ti]
InChI
InChI=1S/3C10H19O.C5H12O.2C3H5.H2O2.O.Ti/c3*1-10(2,3)8-6-4-5-7-9-11;1-5(2,3)4-6;2*1-3-2;1-2;;/h3*4-8H2,1-3H3;6H,4H2,1-3H3;2*3H,1-2H2;1-2H;;/q3*-1;;2*-1;;;
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