CID 154814237

2551117-92-9

Structural Information

Molecular Formula
C7H11NO4
SMILES
COCC1(CCC(=O)N1)C(=O)O
InChI
InChI=1S/C7H11NO4/c1-12-4-7(6(10)11)3-2-5(9)8-7/h2-4H2,1H3,(H,8,9)(H,10,11)
InChIKey
DDTUFYWEZOQHHS-UHFFFAOYSA-N
Compound name
2-(methoxymethyl)-5-oxopyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

173.0688 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.076076 134.8
[M+Na]+ 196.058018 142.0
[M-H]- 172.061524 134.3
[M+NH4]+ 191.102623 155.9
[M+K]+ 212.031958 140.8
[M+H-H2O]+ 156.066060 130.3
[M+HCOO]- 218.067001 153.8
[M+CH3COO]- 232.082651 171.5
[M+Na-2H]- 194.043466 138.4
[M]+ 173.06825142 133.0
[M]- 173.06934858 133.0
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.