CID 119031860

5-amino-4-methyl-1-(pyridin-3-yl)-1h-pyrazole-3-carbonitrile

Structural Information

Molecular Formula
C10H9N5
SMILES
CC1=C(N(N=C1C#N)C2=CN=CC=C2)N
InChI
InChI=1S/C10H9N5/c1-7-9(5-11)14-15(10(7)12)8-3-2-4-13-6-8/h2-4,6H,12H2,1H3
InChIKey
OAEWBOSXVQAOGM-UHFFFAOYSA-N
Compound name
5-amino-4-methyl-1-pyridin-3-ylpyrazole-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.0858 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.09308 142.5
[M+Na]+ 222.07502 153.6
[M-H]- 198.07852 143.8
[M+NH4]+ 217.11962 156.9
[M+K]+ 238.04896 149.3
[M+H-H2O]+ 182.08306 126.5
[M+HCOO]- 244.08400 161.2
[M+CH3COO]- 258.09965 153.5
[M+Na-2H]- 220.06047 146.6
[M]+ 199.08525 136.3
[M]- 199.08635 136.3
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.