CID 24697852

N-(2-aminoethyl)pyridine-3-sulfonamide hydrochloride

Structural Information

Molecular Formula
C7H11N3O2S
SMILES
C1=CC(=CN=C1)S(=O)(=O)NCCN
InChI
InChI=1S/C7H11N3O2S/c8-3-5-10-13(11,12)7-2-1-4-9-6-7/h1-2,4,6,10H,3,5,8H2
InChIKey
AMSXRGCTNXUHNN-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)pyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.0572 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.064476 139.9
[M+Na]+ 224.046418 147.3
[M-H]- 200.049924 141.8
[M+NH4]+ 219.091023 157.2
[M+K]+ 240.020358 144.1
[M+H-H2O]+ 184.054460 133.0
[M+HCOO]- 246.055401 159.1
[M+CH3COO]- 260.071051 183.7
[M+Na-2H]- 222.031866 146.3
[M]+ 201.05665142 139.9
[M]- 201.05774858 139.9
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