CID 6482668

Schembl5003221

Structural Information

Molecular Formula
C19H17F2N5
SMILES
C1CN(CCN1C2=CC=CC=N2)C3=NC(=CN=C3)C4=C(C=C(C=C4)F)F
InChI
InChI=1S/C19H17F2N5/c20-14-4-5-15(16(21)11-14)17-12-22-13-19(24-17)26-9-7-25(8-10-26)18-3-1-2-6-23-18/h1-6,11-13H,7-10H2
InChIKey
PAYIXLDWHCZPTO-UHFFFAOYSA-N
Compound name
2-(2,4-difluorophenyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

353.1452 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.15248 187.7
[M+Na]+ 376.13442 195.4
[M-H]- 352.13792 190.1
[M+NH4]+ 371.17902 192.4
[M+K]+ 392.10836 186.2
[M+H-H2O]+ 336.14246 171.3
[M+HCOO]- 398.14340 198.9
[M+CH3COO]- 412.15905 194.6
[M+Na-2H]- 374.11987 190.2
[M]+ 353.14465 180.5
[M]- 353.14575 180.5
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.