2-[(4-Chlorophenyl)sulfonyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)acrylonitrile

enlarge

Systematic / IUPAC Name: (2E)-2-[(4-Chlorophenyl)sulfonyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)acrylonitrile

ID: Reference4710

Other Names: 2-Propenenitrile, 2-[(4-chlorophenyl)sulfonyl]-3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-, (2E)-

Formula: C17H13ClN2O4S

Spectral Data

2-[(4-Chlorophenyl)sulfonyl]-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)acrylonitrile 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 ESI
Analyzers FT
Last Modification 4/28/2016 1:30:01 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C17H13ClN2O4S/c18-12-1-4-14(5-2-12)25(21,22)15(10-19)11-20-13-3-6-16-17(9-13)24-8-7-23-16/h1-6,9,11,20H,7-8H2/b15-11+
InChI Key JHXFGALEGJNTSF-RVDMUPIBSA-N
Canonical SMILES C1COC2=C(O1)C=CC(=C2)NC=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
CAS
Splash
Other Names 2-Propenenitrile, 2-[(4-chlorophenyl)sulfonyl]-3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-, (2E)-

In Other Databases

PubChem 2820948
ChemSpider 2099176