CID 151506

N-(quinolin-8-yl)methanesulfonamide

Structural Information

Molecular Formula
C10H10N2O2S
SMILES
CS(=O)(=O)NC1=CC=CC2=C1N=CC=C2
InChI
InChI=1S/C10H10N2O2S/c1-15(13,14)12-9-6-2-4-8-5-3-7-11-10(8)9/h2-7,12H,1H3
InChIKey
XYEPUTZVZYUENX-UHFFFAOYSA-N
Compound name
N-quinolin-8-ylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

15
References

18
Patents

222.0463 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.05358 144.1
[M+Na]+ 245.03552 153.7
[M-H]- 221.03902 147.8
[M+NH4]+ 240.08012 162.5
[M+K]+ 261.00946 149.8
[M+H-H2O]+ 205.04356 137.7
[M+HCOO]- 267.04450 162.0
[M+CH3COO]- 281.06015 187.0
[M+Na-2H]- 243.02097 152.7
[M]+ 222.04575 146.6
[M]- 222.04685 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

literature stripe

Patent stripe

patents stripe