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The molecular formula of 2-Cyanopropan-2-yl benzodithioate is C11H11NS2.
The molecular weight of 2-Cyanopropan-2-yl benzodithioate is 221.3 g/mol.
The IUPAC name of 2-Cyanopropan-2-yl benzodithioate is 2-cyanopropan-2-yl benzenecarbodithioate.
The InChI of 2-Cyanopropan-2-yl benzodithioate is InChI=1S/C11H11NS2/c1-11(2,8-12)14-10(13)9-6-4-3-5-7-9/h3-7H,1-2H3.
The InChIKey of 2-Cyanopropan-2-yl benzodithioate is IDSLBLWCPSAZBL-UHFFFAOYSA-N.
The canonical SMILES of 2-Cyanopropan-2-yl benzodithioate is CC(C)(C#N)SC(=S)C1=CC=CC=C1.
The CAS number of 2-Cyanopropan-2-yl benzodithioate is 201611-85-0.
The EC number of 2-Cyanopropan-2-yl benzodithioate is 687-395-9.
Yes, 2-Cyanopropan-2-yl benzodithioate is a canonicalized compound.
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