CID 21146982

Quinoline-2-sulfonamide

Structural Information

Molecular Formula
C9H8N2O2S
SMILES
C1=CC=C2C(=C1)C=CC(=N2)S(=O)(=O)N
InChI
InChI=1S/C9H8N2O2S/c10-14(12,13)9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H2,10,12,13)
InChIKey
URMKWAIIKFEUKR-UHFFFAOYSA-N
Compound name
quinoline-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

454
Patents

208.03065 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.037926 140.1
[M+Na]+ 231.019868 150.1
[M-H]- 207.023374 143.5
[M+NH4]+ 226.064473 158.8
[M+K]+ 246.993808 146.1
[M+H-H2O]+ 191.027910 134.0
[M+HCOO]- 253.028851 157.8
[M+CH3COO]- 267.044501 183.4
[M+Na-2H]- 229.005316 148.1
[M]+ 208.03010142 141.3
[M]- 208.03119858 141.3
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

patents stripe