CID 43362365

Ethyl 1-sulfamoylpyrrolidine-2-carboxylate

Structural Information

Molecular Formula
C7H14N2O4S
SMILES
CCOC(=O)C1CCCN1S(=O)(=O)N
InChI
InChI=1S/C7H14N2O4S/c1-2-13-7(10)6-4-3-5-9(6)14(8,11)12/h6H,2-5H2,1H3,(H2,8,11,12)
InChIKey
JTVSCILRYKVTFP-UHFFFAOYSA-N
Compound name
ethyl 1-sulfamoylpyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.06743 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.074706 147.3
[M+Na]+ 245.056648 154.1
[M-H]- 221.060154 149.0
[M+NH4]+ 240.101253 165.9
[M+K]+ 261.030588 153.0
[M+H-H2O]+ 205.064690 141.6
[M+HCOO]- 267.065631 162.9
[M+CH3COO]- 281.081281 184.2
[M+Na-2H]- 243.042096 147.8
[M]+ 222.06688142 148.1
[M]- 222.06797858 148.1
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.