CID 155821693

(2-oxocyclobutyl)methanesulfonamide

Structural Information

Molecular Formula
C5H9NO3S
SMILES
C1CC(=O)C1CS(=O)(=O)N
InChI
InChI=1S/C5H9NO3S/c6-10(8,9)3-4-1-2-5(4)7/h4H,1-3H2,(H2,6,8,9)
InChIKey
ITZNOKRGUOTUOS-UHFFFAOYSA-N
Compound name
(2-oxocyclobutyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.03032 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.037596 127.6
[M+Na]+ 186.019538 133.2
[M-H]- 162.023044 130.5
[M+NH4]+ 181.064143 141.2
[M+K]+ 201.993478 134.8
[M+H-H2O]+ 146.027580 116.5
[M+HCOO]- 208.028521 144.2
[M+CH3COO]- 222.044171 178.5
[M+Na-2H]- 184.004986 130.5
[M]+ 163.02977142 136.1
[M]- 163.03086858 136.1
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.