CID 82467966

2825006-73-1

Structural Information

Molecular Formula
C8H10N2O2
SMILES
C1CC1N2C=C(N=C2)CC(=O)O
InChI
InChI=1S/C8H10N2O2/c11-8(12)3-6-4-10(5-9-6)7-1-2-7/h4-5,7H,1-3H2,(H,11,12)
InChIKey
AUBDTSXACJTWSF-UHFFFAOYSA-N
Compound name
2-(1-cyclopropylimidazol-4-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.07423 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.081506 138.0
[M+Na]+ 189.063448 148.1
[M-H]- 165.066954 141.8
[M+NH4]+ 184.108053 152.1
[M+K]+ 205.037388 144.5
[M+H-H2O]+ 149.071490 130.7
[M+HCOO]- 211.072431 159.5
[M+CH3COO]- 225.088081 178.4
[M+Na-2H]- 187.048896 141.9
[M]+ 166.07368142 140.3
[M]- 166.07477858 140.3
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.