CID 6483179

Schembl4997603

Structural Information

Molecular Formula
C22H24N4O2
SMILES
COC1=CC=CC(=C1)C2=CN=CC(=N2)N3CCN(CC3)C4=CC(=CC=C4)OC
InChI
InChI=1S/C22H24N4O2/c1-27-19-7-3-5-17(13-19)21-15-23-16-22(24-21)26-11-9-25(10-12-26)18-6-4-8-20(14-18)28-2/h3-8,13-16H,9-12H2,1-2H3
InChIKey
LWMIRTURWGFHFG-UHFFFAOYSA-N
Compound name
2-(3-methoxyphenyl)-6-[4-(3-methoxyphenyl)piperazin-1-yl]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

376.1899 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.19718 194.9
[M+Na]+ 399.17912 200.6
[M-H]- 375.18262 201.0
[M+NH4]+ 394.22372 199.9
[M+K]+ 415.15306 193.9
[M+H-H2O]+ 359.18716 180.3
[M+HCOO]- 421.18810 209.0
[M+CH3COO]- 435.20375 202.2
[M+Na-2H]- 397.16457 197.2
[M]+ 376.18935 192.7
[M]- 376.19045 192.7
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