CID 2786726

2-amino-6-methylpyridine-3,5-dicarbonitrile

Structural Information

Molecular Formula
C8H6N4
SMILES
CC1=NC(=C(C=C1C#N)C#N)N
InChI
InChI=1S/C8H6N4/c1-5-6(3-9)2-7(4-10)8(11)12-5/h2H,1H3,(H2,11,12)
InChIKey
WDPUOYPYEKYTMM-UHFFFAOYSA-N
Compound name
2-amino-6-methylpyridine-3,5-dicarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

158.05925 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.06653 162.2
[M+Na]+ 181.04847 171.0
[M+NH4]+ 176.09307 162.8
[M+K]+ 197.02241 160.8
[M-H]- 157.05197 152.5
[M+Na-2H]- 179.03392 161.7
[M]+ 158.05870 159.4
[M]- 158.05980 159.4
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

patents stripe