CID 3657

Hydroxyurea

Structural Information

Molecular Formula
CH4N2O2
SMILES
C(=O)(N)NO
InChI
InChI=1S/CH4N2O2/c2-1(4)3-5/h5H,(H3,2,3,4)
InChIKey
VSNHCAURESNICA-UHFFFAOYSA-N
Compound name
hydroxyurea
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

11213
References

87248
Patents

76.027275 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 77.034551 110.0
[M+Na]+ 99.016493 117.2
[M-H]- 75.019999 109.1
[M+NH4]+ 94.061098 132.5
[M+K]+ 114.99043 117.6
[M+H-H2O]+ 59.024535 105.5
[M+HCOO]- 121.02548 134.9
[M+CH3COO]- 135.04113 161.6
[M+Na-2H]- 97.001941 117.1
[M]+ 76.026726 106.1
[M]- 76.027824 106.1
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.