CID 6483158

Schembl4997622

Structural Information

Molecular Formula
C20H22N6
SMILES
CC1=CC(=CC(=C1)C2=CN=CC(=N2)N3CCN(CC3)C4=NC=CN=C4)C
InChI
InChI=1S/C20H22N6/c1-15-9-16(2)11-17(10-15)18-12-22-14-20(24-18)26-7-5-25(6-8-26)19-13-21-3-4-23-19/h3-4,9-14H,5-8H2,1-2H3
InChIKey
GWVRTHTXAJJIFS-UHFFFAOYSA-N
Compound name
2-(3,5-dimethylphenyl)-6-(4-pyrazin-2-ylpiperazin-1-yl)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

346.19058 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.19786 191.0
[M+Na]+ 369.17980 198.1
[M-H]- 345.18330 194.6
[M+NH4]+ 364.22440 194.7
[M+K]+ 385.15374 189.4
[M+H-H2O]+ 329.18784 175.8
[M+HCOO]- 391.18878 202.5
[M+CH3COO]- 405.20443 197.8
[M+Na-2H]- 367.16525 194.2
[M]+ 346.19003 186.4
[M]- 346.19113 186.4
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

No patent data available for this compound.