Isovalelyl

Molecular Formula: C28H26CaO6


InChI: InChI=1/2C14H14O3.Ca/c2*1-8(2)7-11(15)12-13(16)9-5-3-4-6-10(9)14(12)17;/h2*3-6,8,16H,7H2,1-2H3;/q;;+2/p-2/f2C14H13O3.Ca/h2*16h;/q2*-1;m

InChIKey: InChIKey=QPYPHJWZWLGYRR-IAVDREDWCZ
SMILES: CC(C)CC(=O)C1=C(C2=CC=CC=C2C1=O)[O-].CC(C)CC(=O)C1=C(C2=CC=CC=C2C1=O)[O-].[Ca+2]

Names:
    Calcium 2-isovaleryl-1,3-indandione
    calcium 2-(3-methylbutanoyl)-3-oxo-inden-1-olate
    Caswell No. 515A
    EPA Pesticide Chemical Code 067706
    Isotrac
    Isovalelyl
    1,3-Indandione, 2-isovaleryl-, ion(1-), calcium
    2-Isovaleryl-1,3-indandione calcium salt
    23710-76-1

Registries:
    PubChem CID 62776
    PubChem ID 204740