CID 3040461

Jdl 145

Structural Information

Molecular Formula
C11H10ClN3O2S
SMILES
C1=CC(=CC(=C1)Cl)NC2=C(C=NC=C2)S(=O)(=O)N
InChI
InChI=1S/C11H10ClN3O2S/c12-8-2-1-3-9(6-8)15-10-4-5-14-7-11(10)18(13,16)17/h1-7H,(H,14,15)(H2,13,16,17)
InChIKey
BBOZOBWUNWFAJH-UHFFFAOYSA-N
Compound name
4-(3-chloroanilino)pyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.01822 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.02550 159.4
[M+Na]+ 306.00744 172.5
[M+NH4]+ 301.05204 167.1
[M+K]+ 321.98138 164.3
[M-H]- 282.01094 163.2
[M+Na-2H]- 303.99289 167.9
[M]+ 283.01767 163.1
[M]- 283.01877 163.1
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.