CID 3016733

81945-73-5

Structural Information

Molecular Formula
C3H4N2O
SMILES
C1=CN(N=C1)O
InChI
InChI=1S/C3H4N2O/c6-5-3-1-2-4-5/h1-3,6H
InChIKey
QVCIPIYWPSPRFA-UHFFFAOYSA-N
Compound name
1-hydroxypyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

3750
Patents

84.032364 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 85.039640 110.9
[M+Na]+ 107.02158 120.4
[M-H]- 83.025088 110.9
[M+NH4]+ 102.06619 133.1
[M+K]+ 122.99552 119.8
[M+H-H2O]+ 67.029624 104.8
[M+HCOO]- 129.03056 134.3
[M+CH3COO]- 143.04622 158.1
[M+Na-2H]- 105.00703 119.4
[M]+ 84.031815 109.9
[M]- 84.032913 109.9
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.