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hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium

hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium

Systemtic Name:hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium
Openeye Name:hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium
CAS Name:13-hexacosanol; 2-methyl-2-propen-1-ol; 2-propanol; titanium
IUPAC Name:hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium
Traditional Name:hexacosan-13-ol; 2-methylprop-2-en-1-ol; propan-2-ol; titanium
Formula: C37H78O4Ti
MolecularWeight: 634.87982
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCCCCCCCCC)O.CC(C)O.CC(=C)CO.CC(=C)CO.[Ti]


Isomeric SMILES

CCCCCCCCCCCCCC(CCCCCCCCCCCC)O.CC(C)O.CC(=C)CO.CC(=C)CO.[Ti]


InChI

InChI=1S/C26H54O.2C4H8O.C3H8O.Ti/c1-3-5-7-9-11-13-15-17-19-21-23-25-26(27)24-22-20-18-16-14-12-10-8-6-4-2;2*1-4(2)3-5;1-3(2)4;/h26-27H,3-25H2,1-2H3;2*5H,1,3H2,2H3;3-4H,1-2H3;


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