CID 6482842

Schembl4997591

Structural Information

Molecular Formula
C24H20F2N4
SMILES
C1CN(CCN1C2=C(C=C(C=C2)F)F)C3=NC(=CN=C3)C4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C24H20F2N4/c25-20-7-8-23(21(26)14-20)29-9-11-30(12-10-29)24-16-27-15-22(28-24)19-6-5-17-3-1-2-4-18(17)13-19/h1-8,13-16H,9-12H2
InChIKey
WFLBXYKBTGMMSV-UHFFFAOYSA-N
Compound name
2-[4-(2,4-difluorophenyl)piperazin-1-yl]-6-naphthalen-2-ylpyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

402.1656 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.17288 202.3
[M+Na]+ 425.15482 209.8
[M-H]- 401.15832 206.6
[M+NH4]+ 420.19942 207.2
[M+K]+ 441.12876 199.4
[M+H-H2O]+ 385.16286 185.3
[M+HCOO]- 447.16380 212.7
[M+CH3COO]- 461.17945 208.4
[M+Na-2H]- 423.14027 204.0
[M]+ 402.16505 195.1
[M]- 402.16615 195.1
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