CID 6482888

Schembl5003446

Structural Information

Molecular Formula
C24H22N4
SMILES
C1CN(CCN1C2=CC=CC=C2)C3=NC(=CN=C3)C4=CC=CC5=CC=CC=C54
InChI
InChI=1S/C24H22N4/c1-2-9-20(10-3-1)27-13-15-28(16-14-27)24-18-25-17-23(26-24)22-12-6-8-19-7-4-5-11-21(19)22/h1-12,17-18H,13-16H2
InChIKey
VPGSKZGIKMATSV-UHFFFAOYSA-N
Compound name
2-naphthalen-1-yl-6-(4-phenylpiperazin-1-yl)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

366.18445 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.19173 192.7
[M+Na]+ 389.17367 198.1
[M-H]- 365.17717 198.9
[M+NH4]+ 384.21827 198.5
[M+K]+ 405.14761 188.9
[M+H-H2O]+ 349.18171 177.4
[M+HCOO]- 411.18265 205.2
[M+CH3COO]- 425.19830 199.5
[M+Na-2H]- 387.15912 197.4
[M]+ 366.18390 186.4
[M]- 366.18500 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

patents stripe