CID 55252983

6-amino-3-methylpyridine-2-carbonitrile

Structural Information

Molecular Formula
C7H7N3
SMILES
CC1=C(N=C(C=C1)N)C#N
InChI
InChI=1S/C7H7N3/c1-5-2-3-7(9)10-6(5)4-8/h2-3H,1H3,(H2,9,10)
InChIKey
NCWREJYHPBUAKT-UHFFFAOYSA-N
Compound name
6-amino-3-methylpyridine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

133.064 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07128 128.7
[M+Na]+ 156.05322 141.0
[M+NH4]+ 151.09782 133.8
[M+K]+ 172.02716 132.0
[M-H]- 132.05672 123.8
[M+Na-2H]- 154.03867 133.3
[M]+ 133.06345 128.2
[M]- 133.06455 128.2
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

patents stripe