CID 36799

34356-73-5

Structural Information

Molecular Formula
C4H6N4O2
SMILES
CN1C(=C(N=C1N)O)N=O
InChI
InChI=1S/C4H6N4O2/c1-8-2(7-10)3(9)6-4(8)5/h9H,1H3,(H2,5,6)
InChIKey
PODSEHFCJNILGG-UHFFFAOYSA-N
Compound name
2-amino-1-methyl-5-nitrosoimidazol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.04907 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.05635 124.0
[M+Na]+ 165.03829 134.7
[M-H]- 141.04179 126.0
[M+NH4]+ 160.08289 144.4
[M+K]+ 181.01223 133.9
[M+H-H2O]+ 125.04633 117.3
[M+HCOO]- 187.04727 150.4
[M+CH3COO]- 201.06292 177.6
[M+Na-2H]- 163.02374 130.1
[M]+ 142.04852 124.6
[M]- 142.04962 124.6
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.