CID 849123

N-(3-chlorophenyl)methanesulfonamide

Structural Information

Molecular Formula
C7H8ClNO2S
SMILES
CS(=O)(=O)NC1=CC(=CC=C1)Cl
InChI
InChI=1S/C7H8ClNO2S/c1-12(10,11)9-7-4-2-3-6(8)5-7/h2-5,9H,1H3
InChIKey
YZTNYEJMDCLPNA-UHFFFAOYSA-N
Compound name
N-(3-chlorophenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

204.99643 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.00371 140.4
[M+Na]+ 227.98565 152.7
[M+NH4]+ 223.03025 149.0
[M+K]+ 243.95959 144.8
[M-H]- 203.98915 142.1
[M+Na-2H]- 225.97110 146.9
[M]+ 204.99588 143.4
[M]- 204.99698 143.4
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

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