CID 130016005

2253629-95-5

Structural Information

Molecular Formula
C8H8N4
SMILES
C1=CC=NC(=C1)NC2=CNN=C2
InChI
InChI=1S/C8H8N4/c1-2-4-9-8(3-1)12-7-5-10-11-6-7/h1-6H,(H,9,12)(H,10,11)
InChIKey
SNXPFJDTPZHLPP-UHFFFAOYSA-N
Compound name
N-(1H-pyrazol-4-yl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

160.07489 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.08217 130.3
[M+Na]+ 183.06411 138.3
[M-H]- 159.06761 131.9
[M+NH4]+ 178.10871 147.5
[M+K]+ 199.03805 134.6
[M+H-H2O]+ 143.07215 121.5
[M+HCOO]- 205.07309 153.1
[M+CH3COO]- 219.08874 143.0
[M+Na-2H]- 181.04956 139.2
[M]+ 160.07434 127.1
[M]- 160.07544 127.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe