CID 65031199

N-[2-(chloromethyl)phenyl]methanesulfonamide

Structural Information

Molecular Formula
C8H10ClNO2S
SMILES
CS(=O)(=O)NC1=CC=CC=C1CCl
InChI
InChI=1S/C8H10ClNO2S/c1-13(11,12)10-8-5-3-2-4-7(8)6-9/h2-5,10H,6H2,1H3
InChIKey
BYAQOVLKPPTEAV-UHFFFAOYSA-N
Compound name
N-[2-(chloromethyl)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.01208 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.01936 144.8
[M+Na]+ 242.00130 156.9
[M+NH4]+ 237.04590 153.2
[M+K]+ 257.97524 148.7
[M-H]- 218.00480 146.5
[M+Na-2H]- 239.98675 151.0
[M]+ 219.01153 147.7
[M]- 219.01263 147.7
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

No patent data available for this compound.