CID 6482818

Schembl4994712

Structural Information

Molecular Formula
C23H26N4O
SMILES
CCOC1=CC=CC=C1C2=CN=CC(=N2)N3CCN(CC3)C4=CC=C(C=C4)C
InChI
InChI=1S/C23H26N4O/c1-3-28-22-7-5-4-6-20(22)21-16-24-17-23(25-21)27-14-12-26(13-15-27)19-10-8-18(2)9-11-19/h4-11,16-17H,3,12-15H2,1-2H3
InChIKey
FGBRZIUNAYZNSM-UHFFFAOYSA-N
Compound name
2-(2-ethoxyphenyl)-6-[4-(4-methylphenyl)piperazin-1-yl]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

374.21066 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.21794 196.3
[M+Na]+ 397.19988 201.8
[M-H]- 373.20338 202.2
[M+NH4]+ 392.24448 201.6
[M+K]+ 413.17382 194.2
[M+H-H2O]+ 357.20792 181.7
[M+HCOO]- 419.20886 209.9
[M+CH3COO]- 433.22451 203.4
[M+Na-2H]- 395.18533 198.1
[M]+ 374.21011 193.1
[M]- 374.21121 193.1
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