CID 145912883

2378499-11-5

Structural Information

Molecular Formula
C6H11NO3S
SMILES
CS(=N)(=O)C1CC(C1)C(=O)O
InChI
InChI=1S/C6H11NO3S/c1-11(7,10)5-2-4(3-5)6(8)9/h4-5,7H,2-3H2,1H3,(H,8,9)
InChIKey
USJKFOALIKABTD-UHFFFAOYSA-N
Compound name
3-(methylsulfonimidoyl)cyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.04596 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.05324 137.8
[M+Na]+ 200.03518 140.7
[M+NH4]+ 195.07978 140.3
[M+K]+ 216.00912 138.3
[M-H]- 176.03868 133.9
[M+Na-2H]- 198.02063 137.2
[M]+ 177.04541 135.9
[M]- 177.04651 135.9
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

No patent data available for this compound.