CID 17803495

2-(4-chlorophenyl)ethane-1-sulfonamide

Structural Information

Molecular Formula
C8H10ClNO2S
SMILES
C1=CC(=CC=C1CCS(=O)(=O)N)Cl
InChI
InChI=1S/C8H10ClNO2S/c9-8-3-1-7(2-4-8)5-6-13(10,11)12/h1-4H,5-6H2,(H2,10,11,12)
InChIKey
VGAKRQYYRQVIOF-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

219.01208 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.01936 142.6
[M+Na]+ 242.00130 152.0
[M-H]- 218.00480 146.4
[M+NH4]+ 237.04590 162.1
[M+K]+ 257.97524 147.1
[M+H-H2O]+ 202.00934 138.1
[M+HCOO]- 264.01028 157.2
[M+CH3COO]- 278.02593 184.0
[M+Na-2H]- 239.98675 146.9
[M]+ 219.01153 145.7
[M]- 219.01263 145.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe