CID 165438305

2-(1-sulfamoylcyclopropyl)aceticacid

Structural Information

Molecular Formula
C5H9NO4S
SMILES
C1CC1(CC(=O)O)S(=O)(=O)N
InChI
InChI=1S/C5H9NO4S/c6-11(9,10)5(1-2-5)3-4(7)8/h1-3H2,(H,7,8)(H2,6,9,10)
InChIKey
GTLHHMBOMVBHCB-UHFFFAOYSA-N
Compound name
2-(1-sulfamoylcyclopropyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.02522 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.03250 141.0
[M+Na]+ 202.01444 149.5
[M+NH4]+ 197.05904 148.8
[M+K]+ 217.98838 145.3
[M-H]- 178.01794 146.2
[M+Na-2H]- 199.99989 146.8
[M]+ 179.02467 145.0
[M]- 179.02577 145.0
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.