CID 300514

2,3-dicyanopyrazine

Structural Information

Molecular Formula
C6H2N4
SMILES
C1=CN=C(C(=N1)C#N)C#N
InChI
InChI=1S/C6H2N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2H
InChIKey
OTVZGAXESBAAQQ-UHFFFAOYSA-N
Compound name
pyrazine-2,3-dicarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2754
Patents

130.02794 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.03522 135.4
[M+Na]+ 153.01716 145.3
[M-H]- 129.02066 136.3
[M+NH4]+ 148.06176 147.6
[M+K]+ 168.99110 143.2
[M+H-H2O]+ 113.02520 118.9
[M+HCOO]- 175.02614 147.2
[M+CH3COO]- 189.04179 207.8
[M+Na-2H]- 151.00261 140.3
[M]+ 130.02739 126.9
[M]- 130.02849 126.9
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