CID 54317

Brn 4571941

Structural Information

Molecular Formula
C25H27N3O
SMILES
CC1=CC=CC=C1N2CCN(CC2)C3=CC=C(C=C3)N=CC4=CC=C(C=C4)OC
InChI
InChI=1S/C25H27N3O/c1-20-5-3-4-6-25(20)28-17-15-27(16-18-28)23-11-9-22(10-12-23)26-19-21-7-13-24(29-2)14-8-21/h3-14,19H,15-18H2,1-2H3
InChIKey
GQFFKJONQORLRU-UHFFFAOYSA-N
Compound name
1-(4-methoxyphenyl)-N-[4-[4-(2-methylphenyl)piperazin-1-yl]phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.21542 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.22270 198.7
[M+Na]+ 408.20464 215.3
[M+NH4]+ 403.24924 206.9
[M+K]+ 424.17858 204.4
[M-H]- 384.20814 208.0
[M+Na-2H]- 406.19009 210.7
[M]+ 385.21487 203.9
[M]- 385.21597 203.9
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.