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(6S)-6-methyl-4-oxidanylidene-octanoic acid

(6S)-6-methyl-4-oxidanylidene-octanoic acid

Systemtic Name:(6S)-6-methyl-4-oxidanylidene-octanoic acid
Openeye Name:(6S)-6-methyl-4-oxo-octanoic acid
CAS Name:(6S)-6-methyl-4-oxooctanoic acid
IUPAC Name:(6S)-6-methyl-4-oxooctanoic acid
Traditional Name:(6S)-4-keto-6-methyl-caprylic acid
Formula: C9H16O3
MolecularWeight: 172.22154
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)CCC(=O)O


Isomeric SMILES

CC[C@H](C)CC(=O)CCC(=O)O


InChI

InChI=1S/C9H16O3/c1-3-7(2)6-8(10)4-5-9(11)12/h7H,3-6H2,1-2H3,(H,11,12)/t7-/m0/s1


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