CID 14876689

1-methyl-2-oxopyrrolidine-3-carboxylic acid

Structural Information

Molecular Formula
C6H9NO3
SMILES
CN1CCC(C1=O)C(=O)O
InChI
InChI=1S/C6H9NO3/c1-7-3-2-4(5(7)8)6(9)10/h4H,2-3H2,1H3,(H,9,10)
InChIKey
LRQXSOWYUQJAOH-UHFFFAOYSA-N
Compound name
1-methyl-2-oxopyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

143.05824 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06552 129.1
[M+Na]+ 166.04746 138.0
[M+NH4]+ 161.09206 135.7
[M+K]+ 182.02140 136.4
[M-H]- 142.05096 127.7
[M+Na-2H]- 164.03291 131.3
[M]+ 143.05769 129.4
[M]- 143.05879 129.4
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