CID 16782255

3-methylquinoline-8-sulfonamide

Structural Information

Molecular Formula
C10H10N2O2S
SMILES
CC1=CC2=C(C(=CC=C2)S(=O)(=O)N)N=C1
InChI
InChI=1S/C10H10N2O2S/c1-7-5-8-3-2-4-9(15(11,13)14)10(8)12-6-7/h2-6H,1H3,(H2,11,13,14)
InChIKey
PDWRLDLLPHKBOS-UHFFFAOYSA-N
Compound name
3-methylquinoline-8-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

222.0463 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.053576 144.7
[M+Na]+ 245.035518 155.1
[M-H]- 221.039024 148.2
[M+NH4]+ 240.080123 163.1
[M+K]+ 261.009458 150.9
[M+H-H2O]+ 205.043560 138.6
[M+HCOO]- 267.044501 161.9
[M+CH3COO]- 281.060151 187.6
[M+Na-2H]- 243.020966 151.5
[M]+ 222.04575142 146.6
[M]- 222.04684858 146.6
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

patents stripe