CID 6483154

Schembl4997700

Structural Information

Molecular Formula
C24H28N4
SMILES
CC1CN(CCN1C2=CC=CC(=C2)C)C3=NC(=CN=C3)C4=CC(=CC(=C4)C)C
InChI
InChI=1S/C24H28N4/c1-17-6-5-7-22(13-17)28-9-8-27(16-20(28)4)24-15-25-14-23(26-24)21-11-18(2)10-19(3)12-21/h5-7,10-15,20H,8-9,16H2,1-4H3
InChIKey
VUANQBNMPXCUEL-UHFFFAOYSA-N
Compound name
2-(3,5-dimethylphenyl)-6-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

372.23138 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.23866 199.3
[M+Na]+ 395.22060 206.5
[M-H]- 371.22410 205.9
[M+NH4]+ 390.26520 205.4
[M+K]+ 411.19454 198.0
[M+H-H2O]+ 355.22864 185.1
[M+HCOO]- 417.22958 212.4
[M+CH3COO]- 431.24523 206.8
[M+Na-2H]- 393.20605 198.9
[M]+ 372.23083 196.0
[M]- 372.23193 196.0
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

No patent data available for this compound.