CID 97620365

2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1h-imidazol-1-yl]acetic acid hydrochloride

Structural Information

Molecular Formula
C8H8N4O3
SMILES
CC1=NOC(=N1)C2=CN(C=N2)CC(=O)O
InChI
InChI=1S/C8H8N4O3/c1-5-10-8(15-11-5)6-2-12(4-9-6)3-7(13)14/h2,4H,3H2,1H3,(H,13,14)
InChIKey
MJNHEMAOQZGQJH-UHFFFAOYSA-N
Compound name
2-[4-(3-methyl-1,2,4-oxadiazol-5-yl)imidazol-1-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.05965 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.06693 141.4
[M+Na]+ 231.04887 153.3
[M+NH4]+ 226.09347 146.4
[M+K]+ 247.02281 154.1
[M-H]- 207.05237 141.6
[M+Na-2H]- 229.03432 146.5
[M]+ 208.05910 142.8
[M]- 208.06020 142.8
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.