CID 9186307

2-bromo-4,5-dimethoxy-n-methylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C9H12BrNO4S
SMILES
CNS(=O)(=O)C1=C(C=C(C(=C1)OC)OC)Br
InChI
InChI=1S/C9H12BrNO4S/c1-11-16(12,13)9-5-8(15-3)7(14-2)4-6(9)10/h4-5,11H,1-3H3
InChIKey
DDLOQCYMDABSIK-UHFFFAOYSA-N
Compound name
2-bromo-4,5-dimethoxy-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.96704 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.97432 147.7
[M+Na]+ 331.95626 149.4
[M+NH4]+ 327.00086 151.0
[M+K]+ 347.93020 149.9
[M-H]- 307.95976 147.0
[M+Na-2H]- 329.94171 149.9
[M]+ 308.96649 146.8
[M]- 308.96759 146.8
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

No patent data available for this compound.