CID 4961679

3-amino-4-(dimethylamino)benzenesulfonamide

Structural Information

Molecular Formula
C8H13N3O2S
SMILES
CN(C)C1=C(C=C(C=C1)S(=O)(=O)N)N
InChI
InChI=1S/C8H13N3O2S/c1-11(2)8-4-3-6(5-7(8)9)14(10,12)13/h3-5H,9H2,1-2H3,(H2,10,12,13)
InChIKey
PHVMXZQQFSAFPX-UHFFFAOYSA-N
Compound name
3-amino-4-(dimethylamino)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

215.07285 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.08013 145.6
[M+Na]+ 238.06207 154.2
[M+NH4]+ 233.10667 152.6
[M+K]+ 254.03601 149.1
[M-H]- 214.06557 147.7
[M+Na-2H]- 236.04752 150.4
[M]+ 215.07230 147.5
[M]- 215.07340 147.5
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