CID 43132024

1,2,3,4-tetrahydroquinoline-1-sulfonamide

Structural Information

Molecular Formula
C9H12N2O2S
SMILES
C1CC2=CC=CC=C2N(C1)S(=O)(=O)N
InChI
InChI=1S/C9H12N2O2S/c10-14(12,13)11-7-3-5-8-4-1-2-6-9(8)11/h1-2,4,6H,3,5,7H2,(H2,10,12,13)
InChIKey
XBVDUBWHMSFQLE-UHFFFAOYSA-N
Compound name
3,4-dihydro-2H-quinoline-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

212.06195 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.06923 142.2
[M+Na]+ 235.05117 150.1
[M-H]- 211.05467 144.7
[M+NH4]+ 230.09577 160.5
[M+K]+ 251.02511 146.5
[M+H-H2O]+ 195.05921 136.1
[M+HCOO]- 257.06015 156.9
[M+CH3COO]- 271.07580 184.1
[M+Na-2H]- 233.03662 148.4
[M]+ 212.06140 140.6
[M]- 212.06250 140.6
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