CID 6879893

N-((1,1'-biphenyl)-4-ylmethylene)-4-(4-methylbenzyl)-1-piperazinamine

Structural Information

Molecular Formula
C25H27N3
SMILES
CC1=CC=C(C=C1)CN2CCN(CC2)/N=C/C3=CC=C(C=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H27N3/c1-21-7-9-23(10-8-21)20-27-15-17-28(18-16-27)26-19-22-11-13-25(14-12-22)24-5-3-2-4-6-24/h2-14,19H,15-18,20H2,1H3/b26-19+
InChIKey
OJJQFQWIMMDKOB-LGUFXXKBSA-N
Compound name
(E)-N-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-1-(4-phenylphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.2205 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.22778 195.5
[M+Na]+ 392.20972 212.3
[M+NH4]+ 387.25432 204.3
[M+K]+ 408.18366 200.6
[M-H]- 368.21322 205.2
[M+Na-2H]- 390.19517 208.2
[M]+ 369.21995 200.9
[M]- 369.22105 200.9
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.