1-oxidanylideneoctan-2-yl thiocyanate

Systemtic Name: 1-oxidanylideneoctan-2-yl thiocyanate Openeye Name: 1-formylheptyl thiocyanate CAS Name: thiocyanic acid 1-oxooctan-2-yl ester IUPAC Name: 1-oxooctan-2-yl thiocyanate Traditional Name: thiocyanic acid 1-formylheptyl ester Formula: C9H15NOS MolecularWeight: 185.2865

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C=O)SC#N

Isomeric SMILES

CCCCCCC(C=O)SC#N

InChI

InChI=1S/C9H15NOS/c1-2-3-4-5-6-9(7-11)12-8-10/h7,9H,2-6H2,1H3