CID 235530

3-amino-4-methoxy-n,n-dimethylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C9H14N2O3S
SMILES
CN(C)S(=O)(=O)C1=CC(=C(C=C1)OC)N
InChI
InChI=1S/C9H14N2O3S/c1-11(2)15(12,13)7-4-5-9(14-3)8(10)6-7/h4-6H,10H2,1-3H3
InChIKey
LEDOHLBFUWTDPD-UHFFFAOYSA-N
Compound name
3-amino-4-methoxy-N,N-dimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

230.07251 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.079786 147.5
[M+Na]+ 253.061728 155.6
[M-H]- 229.065234 152.6
[M+NH4]+ 248.106333 166.0
[M+K]+ 269.035668 154.2
[M+H-H2O]+ 213.069770 141.0
[M+HCOO]- 275.070711 167.8
[M+CH3COO]- 289.086361 194.9
[M+Na-2H]- 251.047176 151.0
[M]+ 230.07196142 151.2
[M]- 230.07305858 151.2
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