CID 16790646

3-amino-n-[2-(dimethylamino)ethyl]benzene-1-sulfonamide

Structural Information

Molecular Formula
C10H17N3O2S
SMILES
CN(C)CCNS(=O)(=O)C1=CC=CC(=C1)N
InChI
InChI=1S/C10H17N3O2S/c1-13(2)7-6-12-16(14,15)10-5-3-4-9(11)8-10/h3-5,8,12H,6-7,11H2,1-2H3
InChIKey
YVGOHSSSSROEQY-UHFFFAOYSA-N
Compound name
3-amino-N-[2-(dimethylamino)ethyl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

42
Patents

243.10414 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.11142 153.8
[M+Na]+ 266.09336 162.0
[M+NH4]+ 261.13796 160.6
[M+K]+ 282.06730 155.9
[M-H]- 242.09686 155.9
[M+Na-2H]- 264.07881 158.9
[M]+ 243.10359 155.7
[M]- 243.10469 155.7
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