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4-methylpentan-2-one; thiocyanic acid

4-methylpentan-2-one; thiocyanic acid

Systemtic Name:4-methylpentan-2-one; thiocyanic acid
Openeye Name:4-methylpentan-2-one; thiocyanic acid
CAS Name:4-methyl-2-pentanone; thiocyanic acid
IUPAC Name:4-methylpentan-2-one; thiocyanic acid
Traditional Name:4-methylpentan-2-one; thiocyanic acid
Formula: C7H13NOS
MolecularWeight: 159.24922
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C6H12O.CHNS/c1-5(2)4-6(3)7;2-1-3/h5H,4H2,1-3H3;3H


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