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]+ 370.227776 193.8
[M+Na]+ 392.209718 197.6
[M-H]- 368.213224 203.1
[M+NH4]+ 387.254323 202.3
[M+K]+ 408.183658 189.9
[M+H-H2O]+ 352.217760 180.1
[M+HCOO]- 414.218701 212.3
[M+CH3COO]- 428.234351 201.7
[M+Na-2H]- 390.195166 196.3
[M]+ 369.21995142 189.0
[M]- 369.22104858 189.0
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.