CID 5342960

304908-83-6

Structural Information

Molecular Formula
C18H20FN3
SMILES
C1CN(CCN1CC2=CC=CC=C2)/N=C/C3=CC=C(C=C3)F
InChI
InChI=1S/C18H20FN3/c19-18-8-6-16(7-9-18)14-20-22-12-10-21(11-13-22)15-17-4-2-1-3-5-17/h1-9,14H,10-13,15H2/b20-14+
InChIKey
XQWPPFJWBZMAGP-XSFVSMFZSA-N
Compound name
(E)-N-(4-benzylpiperazin-1-yl)-1-(4-fluorophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

297.16412 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.17140 171.0
[M+Na]+ 320.15334 175.9
[M-H]- 296.15684 176.5
[M+NH4]+ 315.19794 182.9
[M+K]+ 336.12728 170.0
[M+H-H2O]+ 280.16138 158.5
[M+HCOO]- 342.16232 189.8
[M+CH3COO]- 356.17797 180.4
[M+Na-2H]- 318.13879 175.1
[M]+ 297.16357 165.4
[M]- 297.16467 165.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.