CID 3549881

374553-94-3

Structural Information

Molecular Formula
C3H4N4O3
SMILES
C(C(=O)O)N1NC(=O)N=N1
InChI
InChI=1S/C3H4N4O3/c8-2(9)1-7-5-3(10)4-6-7/h1H2,(H,5,10)(H,8,9)
InChIKey
RRRXKDJSULCXTB-UHFFFAOYSA-N
Compound name
2-(5-oxo-1H-tetrazol-2-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.02834 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.03562 126.5
[M+Na]+ 167.01756 136.2
[M+NH4]+ 162.06216 130.8
[M+K]+ 182.99150 135.9
[M-H]- 143.02106 122.4
[M+Na-2H]- 165.00301 129.5
[M]+ 144.02779 126.1
[M]- 144.02889 126.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.