CID 165886724

Ethyl 2-fluoro-2-sulfamoylacetate

Structural Information

Molecular Formula
C4H8FNO4S
SMILES
CCOC(=O)C(F)S(=O)(=O)N
InChI
InChI=1S/C4H8FNO4S/c1-2-10-4(7)3(5)11(6,8)9/h3H,2H2,1H3,(H2,6,8,9)
InChIKey
ODQGDZGMQPUOHO-UHFFFAOYSA-N
Compound name
ethyl 2-fluoro-2-sulfamoylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.01581 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.02309 132.8
[M+Na]+ 208.00503 140.2
[M-H]- 184.00853 131.6
[M+NH4]+ 203.04963 152.2
[M+K]+ 223.97897 139.7
[M+H-H2O]+ 168.01307 127.0
[M+HCOO]- 230.01401 148.9
[M+CH3COO]- 244.02966 178.6
[M+Na-2H]- 205.99048 134.8
[M]+ 185.01526 134.1
[M]- 185.01636 134.1
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.