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]+ 174.07608 134.8
[M+Na]+ 196.05802 142.0
[M-H]- 172.06152 134.3
[M+NH4]+ 191.10262 155.9
[M+K]+ 212.03196 140.8
[M+H-H2O]+ 156.06606 130.3
[M+HCOO]- 218.06700 153.8
[M+CH3COO]- 232.08265 171.5
[M+Na-2H]- 194.04347 138.4
[M]+ 173.06825 133.0
[M]- 173.06935 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.