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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	143.05635	125.5
[M+Na]+	165.03829	135.2
[M+NH4]+	160.08289	131.8
[M+K]+	181.01223	133.8
[M-H]-	141.04179	125.5
[M+Na-2H]-	163.02374	129.8
[M]+	142.04852	126.3
[M]-	142.04962	126.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.