CID 165438305

2386237-28-9

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 131.9
[M+Na]+ 202.01444 140.8
[M-H]- 178.01794 134.8
[M+NH4]+ 197.05904 147.7
[M+K]+ 217.98838 138.3
[M+H-H2O]+ 162.02248 127.9
[M+HCOO]- 224.02342 148.2
[M+CH3COO]- 238.03907 177.8
[M+Na-2H]- 199.99989 136.9
[M]+ 179.02467 135.4
[M]- 179.02577 135.4
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.