97259-88-6 Purity
96%
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PubChem CID 57357049.
The molecular formula is C15H33NO5.
The synonyms are 97259-94-4, EINECS 306-458-0, and DTXSID90242836.
The molecular weight is 307.43 g/mol.
The component compounds are Triethanolamine (CID 7618) and 2,2-Dimethylheptanoic acid (CID 9801869).
The IUPAC name is 2,2-dimethylheptanoate;tris(2-hydroxyethyl)azanium.
The InChI is InChI=1S/C9H18O2.C6H15NO3/c1-4-5-6-7-9(2,3)8(10)11;8-4-1-7(2-5-9)3-6-10/h4-7H2,1-3H3,(H,10,11);8-10H,1-6H2.
The InChIKey is YDBGWUWOAKILBV-UHFFFAOYSA-N.
The canonical SMILES is CCCCCC(C)(C)C(=O)[O-].C(CO)[NH+](CCO)CCO.
The CAS number is 97259-94-4.