CID 2755675

3157-65-1

Structural Information

Molecular Formula
C14H12ClNO2S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N=CC2=CC=C(C=C2)Cl
InChI
InChI=1S/C14H12ClNO2S/c1-11-2-8-14(9-3-11)19(17,18)16-10-12-4-6-13(15)7-5-12/h2-10H,1H3
InChIKey
LKDZCWUUTSGZNH-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)methylidene]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

293.02774 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.03502 163.1
[M+Na]+ 316.01696 173.3
[M-H]- 292.02046 171.9
[M+NH4]+ 311.06156 180.6
[M+K]+ 331.99090 167.2
[M+H-H2O]+ 276.02500 156.7
[M+HCOO]- 338.02594 179.7
[M+CH3COO]- 352.04159 200.5
[M+Na-2H]- 314.00241 167.9
[M]+ 293.02719 168.6
[M]- 293.02829 168.6
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.