CID 13135518

N,n-dimethylisoquinoline-5-sulfonamide

Structural Information

Molecular Formula
C11H12N2O2S
SMILES
CN(C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2
InChI
InChI=1S/C11H12N2O2S/c1-13(2)16(14,15)11-5-3-4-9-8-12-7-6-10(9)11/h3-8H,1-2H3
InChIKey
MRHJXMWWAQWJDD-UHFFFAOYSA-N
Compound name
N,N-dimethylisoquinoline-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

236.06195 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.06923 149.0
[M+Na]+ 259.05117 161.8
[M+NH4]+ 254.09577 157.5
[M+K]+ 275.02511 154.0
[M-H]- 235.05467 151.3
[M+Na-2H]- 257.03662 156.2
[M]+ 236.06140 152.0
[M]- 236.06250 152.0
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