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2-methyl-2-[(E)-prop-1-enyl]octanoate

2-methyl-2-[(E)-prop-1-enyl]octanoate

Systemtic Name:2-methyl-2-[(E)-prop-1-enyl]octanoate
Openeye Name:2-methyl-2-[(E)-prop-1-enyl]octanoate
CAS Name:2-methyl-2-[(E)-prop-1-enyl]octanoate
IUPAC Name:2-methyl-2-[(E)-prop-1-enyl]octanoate
Traditional Name:(E)-2-hexyl-2-methyl-pent-3-enoate
Formula: C12H21O2-
MolecularWeight: 197.29394
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C=CC)C(=O)[O-]


Isomeric SMILES

CCCCCCC(C)(/C=C/C)C(=O)[O-]


InChI

InChI=1S/C12H22O2/c1-4-6-7-8-10-12(3,9-5-2)11(13)14/h5,9H,4,6-8,10H2,1-3H3,(H,13,14)/p-1/b9-5+


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