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calcium 4-methyl-2-oxidanylidene-pentanoate

calcium 4-methyl-2-oxidanylidene-pentanoate

Systemtic Name:calcium 4-methyl-2-oxidanylidene-pentanoate
Openeye Name:calcium 4-methyl-2-oxo-pentanoate
CAS Name:calcium 4-methyl-2-oxopentanoate
IUPAC Name:calcium 4-methyl-2-oxopentanoate
Traditional Name:calcium 2-keto-4-methyl-valerate
Formula: C12H18CaO6
MolecularWeight: 298.34572
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)C(=O)[O-].CC(C)CC(=O)C(=O)[O-].[Ca+2]


Isomeric SMILES

CC(C)CC(=O)C(=O)[O-].CC(C)CC(=O)C(=O)[O-].[Ca+2]


InChI

InChI=1S/2C6H10O3.Ca/c2*1-4(2)3-5(7)6(8)9;/h2*4H,3H2,1-2H3,(H,8,9);/q;;+2/p-2


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