CID 18377217

1h-imidazol-4-ol

Structural Information

Molecular Formula
C3H4N2O
SMILES
C1=C(NC=N1)O
InChI
InChI=1S/C3H4N2O/c6-3-1-4-2-5-3/h1-2,6H,(H,4,5)
InChIKey
VKFMHRMTBYXHKO-UHFFFAOYSA-N
Compound name
1H-imidazol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

5769
Patents

84.032364 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 85.039640 111.8
[M+Na]+ 107.02158 120.9
[M-H]- 83.025088 110.4
[M+NH4]+ 102.06619 133.4
[M+K]+ 122.99552 119.3
[M+H-H2O]+ 67.029624 105.9
[M+HCOO]- 129.03056 133.7
[M+CH3COO]- 143.04622 155.4
[M+Na-2H]- 105.00703 119.8
[M]+ 84.031815 108.9
[M]- 84.032913 108.9
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.