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heptan-2-yl 2-oxidanylidenehexanoate

heptan-2-yl 2-oxidanylidenehexanoate

Systemtic Name:heptan-2-yl 2-oxidanylidenehexanoate
Openeye Name:1-methylhexyl 2-oxohexanoate
CAS Name:2-oxohexanoic acid heptan-2-yl ester
IUPAC Name:heptan-2-yl 2-oxohexanoate
Traditional Name:2-ketohexanoic acid 1-methylhexyl ester
Formula: C13H24O3
MolecularWeight: 228.32786
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)OC(=O)C(=O)CCCC


Isomeric SMILES

CCCCCC(C)OC(=O)C(=O)CCCC


InChI

InChI=1S/C13H24O3/c1-4-6-8-9-11(3)16-13(15)12(14)10-7-5-2/h11H,4-10H2,1-3H3


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