2-Cyano-2-propyl benzodithioate

enlarge

Systematic / IUPAC Name: 2-Cyanopropan-2-yl benzenecarbodithioate

ID: Reference2667

Other Names: 1-Cyano-1-methylethyl benzenecarbodithioate;
Benzenecarbodithioic acid, 1-cyano-1-methylethyl ester;
2-Cyanopropan-2-yl benzodithioate

Formula: C11H11NS2

Class: Extractables/Leachables Industrial Chemicals

Spectral Data

2-Cyano-2-propyl benzodithioate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods APCI
Analyzers FT
Last Modification 3/16/2016 1:11:35 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C11H11NS2/c1-11(2,8-12)14-10(13)9-6-4-3-5-7-9/h3-7H,1-2H3
InChI Key IDSLBLWCPSAZBL-UHFFFAOYSA-N
Canonical SMILES CC(C)(C#N)SC(=S)C1=CC=CC=C1
CAS 201611850
Splash
Other Names 1-Cyano-1-methylethyl benzenecarbodithioate;
Benzenecarbodithioic acid, 1-cyano-1-methylethyl ester;
2-Cyanopropan-2-yl benzodithioate

In Other Databases

PubChem 9964525
ChemSpider 8140118