decan-3-one; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: decan-3-one; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: decan-3-one; 2,2,2-trifluoroacetate CAS Name: 3-decanone; 2,2,2-trifluoroacetate IUPAC Name: decan-3-one; 2,2,2-trifluoroacetate Traditional Name: decan-3-one; 2,2,2-trifluoroacetate Formula: C12H20F3O3- MolecularWeight: 269.28061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)CC.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CCCCCCCC(=O)CC.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C10H20O.C2HF3O2/c1-3-5-6-7-8-9-10(11)4-2;3-2(4,5)1(6)7/h3-9H2,1-2H3;(H,6,7)/p-1