(3S,4S)-3-methyl-4-oxidanyl-dodecan-2-one

Systemtic Name: (3S,4S)-3-methyl-4-oxidanyl-dodecan-2-one Openeye Name: (3S,4S)-4-hydroxy-3-methyl-dodecan-2-one CAS Name: (3S,4S)-4-hydroxy-3-methyl-2-dodecanone IUPAC Name: (3S,4S)-4-hydroxy-3-methyldodecan-2-one Traditional Name: (3S,4S)-4-hydroxy-3-methyl-dodecan-2-one Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(C)C(=O)C)O

Isomeric SMILES

CCCCCCCC[C@@H]([C@H](C)C(=O)C)O

InChI

InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-13(15)11(2)12(3)14/h11,13,15H,4-10H2,1-3H3/t11-,13+/m1/s1