2-(tert-Butylsulfonyl)-3-(pyrimidin-2-ylamino)acrylonitrile
6107
Reference
2-(tert-Butylsulfonyl)-3-(pyrimidin-2-ylamino)acrylonitrile Structure
Systematic / IUPAC Name: (2E)-2-[(2-Methyl-2-propanyl)sulfonyl]-3-(2-pyrimidinylamino)acrylonitrile
ID: Reference6107
Other Names: 2-Propenenitrile, 2-[(1,1-dimethylethyl)sulfonyl]-3-(2-pyrimidinylamino)-, (2E)-
Formula: C11H14N4O2S
Spectral Data
2-(tert-Butylsulfonyl)-3-(pyrimidin-2-ylamino)acrylonitrile mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 119 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 11/28/2016 7:01:22 AM |
Identificators
| InChI | InChI=1S/C11H14N4O2S/c1-11(2,3)18(16,17)9(7-12)8-15-10-13-5-4-6-14-10/h4-6,8H,1-3H3,(H,13,14,15)/b9-8+ |
| InChI Key | IKETXPJRBVZTRN-CMDGGOBGSA-N |
| Canonical SMILES | CC(C)(C)S(=O)(=O)C(=CNC1=NC=CC=N1)C#N |
| CAS | |
| Splash | |
| Other Names | 2-Propenenitrile, 2-[(1,1-dimethylethyl)sulfonyl]-3-(2-pyrimidinylamino)-, (2E)- |