CID 66619950

1378386-85-6

Structural Information

Molecular Formula
C6H9NO3
SMILES
COC(=O)[C@@H]1CC(=O)CN1
InChI
InChI=1S/C6H9NO3/c1-10-6(9)5-2-4(8)3-7-5/h5,7H,2-3H2,1H3/t5-/m0/s1
InChIKey
HUGQRODTQXEKHL-YFKPBYRVSA-N
Compound name
methyl (2S)-4-oxopyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

143.05824 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06552 129.7
[M+Na]+ 166.04746 138.3
[M+NH4]+ 161.09206 136.4
[M+K]+ 182.02140 136.5
[M-H]- 142.05096 128.3
[M+Na-2H]- 164.03291 132.1
[M]+ 143.05769 130.0
[M]- 143.05879 130.0
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

patents stripe