CID 82651562

2243507-17-5

Structural Information

Molecular Formula
C7H8N2O2
SMILES
C1CC2=CN=C(N2C1)C(=O)O
InChI
InChI=1S/C7H8N2O2/c10-7(11)6-8-4-5-2-1-3-9(5)6/h4H,1-3H2,(H,10,11)
InChIKey
JKOWHARAVWDXBF-UHFFFAOYSA-N
Compound name
6,7-dihydro-5H-pyrrolo[1,2-c]imidazole-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.05858 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 130.4
[M+Na]+ 175.04780 139.8
[M+NH4]+ 170.09240 138.0
[M+K]+ 191.02174 139.4
[M-H]- 151.05130 129.4
[M+Na-2H]- 173.03325 133.4
[M]+ 152.05803 131.0
[M]- 152.05913 131.0
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.