CID 4961680

5-amino-2-methoxy-n,n-dimethylbenzenesulfonamide

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

230.07251 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.07979 147.5
[M+Na]+ 253.06173 155.6
[M-H]- 229.06523 152.6
[M+NH4]+ 248.10633 166.0
[M+K]+ 269.03567 154.2
[M+H-H2O]+ 213.06977 141.0
[M+HCOO]- 275.07071 167.8
[M+CH3COO]- 289.08636 194.9
[M+Na-2H]- 251.04718 151.0
[M]+ 230.07196 151.2
[M]- 230.07306 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