CID 45088191

5-(dimethylamino)pyrazine-2-carbonitrile

Structural Information

Molecular Formula
C7H8N4
SMILES
CN(C)C1=NC=C(N=C1)C#N
InChI
InChI=1S/C7H8N4/c1-11(2)7-5-9-6(3-8)4-10-7/h4-5H,1-2H3
InChIKey
SOOIJJUGROUJPT-UHFFFAOYSA-N
Compound name
5-(dimethylamino)pyrazine-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

148.07489 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.08217 128.0
[M+Na]+ 171.06411 137.6
[M-H]- 147.06761 129.6
[M+NH4]+ 166.10871 144.8
[M+K]+ 187.03805 136.9
[M+H-H2O]+ 131.07215 113.5
[M+HCOO]- 193.07309 148.1
[M+CH3COO]- 207.08874 193.6
[M+Na-2H]- 169.04956 135.6
[M]+ 148.07434 123.6
[M]- 148.07544 123.6
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.