CID 11252198

5906-30-9

Structural Information

Molecular Formula
C4H11N3O2S
SMILES
C1CN(CCN1)S(=O)(=O)N
InChI
InChI=1S/C4H11N3O2S/c5-10(8,9)7-3-1-6-2-4-7/h6H,1-4H2,(H2,5,8,9)
InChIKey
DWXLVZSMXXCSMJ-UHFFFAOYSA-N
Compound name
piperazine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

990
Patents

165.0572 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.06448 133.0
[M+Na]+ 188.04642 139.1
[M-H]- 164.04992 131.5
[M+NH4]+ 183.09102 149.7
[M+K]+ 204.02036 136.5
[M+H-H2O]+ 148.05446 126.7
[M+HCOO]- 210.05540 145.0
[M+CH3COO]- 224.07105 171.0
[M+Na-2H]- 186.03187 137.0
[M]+ 165.05665 127.2
[M]- 165.05775 127.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe