CID 165499964

3-(1h-imidazol-5-yl)-4-methyl-1h-pyrazol-5-amine

Structural Information

Molecular Formula
C7H9N5
SMILES
CC1=C(NN=C1N)C2=CN=CN2
InChI
InChI=1S/C7H9N5/c1-4-6(11-12-7(4)8)5-2-9-3-10-5/h2-3H,1H3,(H,9,10)(H3,8,11,12)
InChIKey
JEOMXUXCMUNASF-UHFFFAOYSA-N
Compound name
5-(1H-imidazol-5-yl)-4-methyl-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.0858 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.093076 132.0
[M+Na]+ 186.075018 142.6
[M-H]- 162.078524 132.1
[M+NH4]+ 181.119623 149.3
[M+K]+ 202.048958 138.3
[M+H-H2O]+ 146.083060 123.6
[M+HCOO]- 208.084001 153.9
[M+CH3COO]- 222.099651 144.8
[M+Na-2H]- 184.060466 136.5
[M]+ 163.08525142 129.2
[M]- 163.08634858 129.2
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.