CID 13925295

3-aminopyrazine-2,6-dicarbonitrile

Structural Information

Molecular Formula
C6H3N5
SMILES
C1=C(N=C(C(=N1)N)C#N)C#N
InChI
InChI=1S/C6H3N5/c7-1-4-3-10-6(9)5(2-8)11-4/h3H,(H2,9,10)
InChIKey
SVUGJCIZAIHMMN-UHFFFAOYSA-N
Compound name
3-aminopyrazine-2,6-dicarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

145.03885 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.04613 140.6
[M+Na]+ 168.02807 150.1
[M-H]- 144.03157 141.2
[M+NH4]+ 163.07267 152.0
[M+K]+ 184.00201 148.4
[M+H-H2O]+ 128.03611 124.0
[M+HCOO]- 190.03705 152.4
[M+CH3COO]- 204.05270 211.2
[M+Na-2H]- 166.01352 144.2
[M]+ 145.03830 131.0
[M]- 145.03940 131.0
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