CID 83482177

5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylic acid

Structural Information

Molecular Formula
C9H9NO3
SMILES
C1CC2=C(C=CC(=O)N2C1)C(=O)O
InChI
InChI=1S/C9H9NO3/c11-8-4-3-6(9(12)13)7-2-1-5-10(7)8/h3-4H,1-2,5H2,(H,12,13)
InChIKey
CWEVPKZNWXMASF-UHFFFAOYSA-N
Compound name
5-oxo-2,3-dihydro-1H-indolizine-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.05824 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.06552 135.2
[M+Na]+ 202.04746 146.5
[M+NH4]+ 197.09206 142.8
[M+K]+ 218.02140 143.5
[M-H]- 178.05096 135.2
[M+Na-2H]- 200.03291 139.2
[M]+ 179.05769 136.5
[M]- 179.05879 136.5
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.