CID 768903

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

Structural Information

Molecular Formula
C9H13NO4S
SMILES
CNS(=O)(=O)C1=C(C=CC(=C1)OC)OC
InChI
InChI=1S/C9H13NO4S/c1-10-15(11,12)9-6-7(13-2)4-5-8(9)14-3/h4-6,10H,1-3H3
InChIKey
DBFYCPPMAVPSBV-UHFFFAOYSA-N
Compound name
2,5-dimethoxy-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

11
Patents

231.05653 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.06381 148.9
[M+Na]+ 254.04575 159.4
[M+NH4]+ 249.09035 155.7
[M+K]+ 270.01969 153.2
[M-H]- 230.04925 149.5
[M+Na-2H]- 252.03120 153.8
[M]+ 231.05598 150.9
[M]- 231.05708 150.9
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