CID 43449117

3-amino-4-[(2-methoxyethyl)amino]-n-methylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C10H17N3O3S
SMILES
CNS(=O)(=O)C1=CC(=C(C=C1)NCCOC)N
InChI
InChI=1S/C10H17N3O3S/c1-12-17(14,15)8-3-4-10(9(11)7-8)13-5-6-16-2/h3-4,7,12-13H,5-6,11H2,1-2H3
InChIKey
ONGGAOXTMCAIAD-UHFFFAOYSA-N
Compound name
3-amino-4-(2-methoxyethylamino)-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.09906 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.10634 154.9
[M+Na]+ 282.08828 161.4
[M-H]- 258.09178 158.0
[M+NH4]+ 277.13288 171.0
[M+K]+ 298.06222 158.1
[M+H-H2O]+ 242.09632 147.7
[M+HCOO]- 304.09726 175.2
[M+CH3COO]- 318.11291 200.0
[M+Na-2H]- 280.07373 159.1
[M]+ 259.09851 156.8
[M]- 259.09961 156.8
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.