CID 257501

Styrene sulfonamide

Structural Information

Molecular Formula
C8H9NO2S
SMILES
C1=CC=C(C=C1)C=CS(=O)(=O)N
InChI
InChI=1S/C8H9NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-7H,(H2,9,10,11)
InChIKey
SHPHBMZZXHFXDF-UHFFFAOYSA-N
Compound name
2-phenylethenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

15
References

610
Patents

183.0354 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.04268 136.3
[M+Na]+ 206.02462 144.6
[M-H]- 182.02812 139.8
[M+NH4]+ 201.06922 156.1
[M+K]+ 221.99856 140.9
[M+H-H2O]+ 166.03266 130.7
[M+HCOO]- 228.03360 155.7
[M+CH3COO]- 242.04925 177.4
[M+Na-2H]- 204.01007 141.6
[M]+ 183.03485 136.3
[M]- 183.03595 136.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe