4-isothiocyanato-4-methyl-pentan-2-ol

Systemtic Name: 4-isothiocyanato-4-methyl-pentan-2-ol Openeye Name: 4-isothiocyanato-4-methyl-pentan-2-ol CAS Name: 4-isothiocyanato-4-methyl-2-pentanol IUPAC Name: 4-isothiocyanato-4-methylpentan-2-ol Traditional Name: 4-isothiocyanato-4-methyl-pentan-2-ol Formula: C7H13NOS MolecularWeight: 159.24922

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)N=C=S)O

Isomeric SMILES

CC(CC(C)(C)N=C=S)O

InChI

InChI=1S/C7H13NOS/c1-6(9)4-7(2,3)8-5-10/h6,9H,4H2,1-3H3