(3S,4R)-3-methyldodec-1-en-5-yn-4-ol

Systemtic Name: (3S,4R)-3-methyldodec-1-en-5-yn-4-ol Openeye Name: (3S,4R)-3-methyldodec-1-en-5-yn-4-ol CAS Name: (3S,4R)-3-methyl-4-dodec-1-en-5-ynol IUPAC Name: (3S,4R)-3-methyldodec-1-en-5-yn-4-ol Traditional Name: (3S,4R)-3-methyldodec-1-en-5-yn-4-ol Formula: C13H22O MolecularWeight: 194.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC(C(C)C=C)O

Isomeric SMILES

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

InChI

InChI=1S/C13H22O/c1-4-6-7-8-9-10-11-13(14)12(3)5-2/h5,12-14H,2,4,6-9H2,1,3H3/t12-,13-/m0/s1