(2S)-2-[(1S)-2-methyl-1-oxidanyl-propyl]nonanal

Systemtic Name: (2S)-2-[(1S)-2-methyl-1-oxidanyl-propyl]nonanal Openeye Name: (2S)-2-[(1S)-1-hydroxy-2-methyl-propyl]nonanal CAS Name: (2S)-2-[(1S)-1-hydroxy-2-methylpropyl]nonanal IUPAC Name: (2S)-2-[(1S)-1-hydroxy-2-methylpropyl]nonanal Traditional Name: (2S)-2-[(1S)-1-hydroxy-2-methyl-propyl]pelargonaldehyde Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C=O)C(C(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C13H26O2/c1-4-5-6-7-8-9-12(10-14)13(15)11(2)3/h10-13,15H,4-9H2,1-3H3/t12-,13+/m1/s1