CID 6282936

Nsc-676468

Structural Information

Molecular Formula
C27H22N2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)N/C=C/C=NC3=CC=C(C=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H22N2/c1-3-8-22(9-4-1)24-12-16-26(17-13-24)28-20-7-21-29-27-18-14-25(15-19-27)23-10-5-2-6-11-23/h1-21,28H/b20-7+,29-21?
InChIKey
NMTVOLGEUFUEOW-UUBFXEKFSA-N
Compound name
4-phenyl-N-[(E)-3-(4-phenylphenyl)iminoprop-1-enyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

374.17828 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.18556 192.9
[M+Na]+ 397.16750 197.6
[M-H]- 373.17100 205.4
[M+NH4]+ 392.21210 203.5
[M+K]+ 413.14144 189.0
[M+H-H2O]+ 357.17554 180.9
[M+HCOO]- 419.17648 218.8
[M+CH3COO]- 433.19213 202.3
[M+Na-2H]- 395.15295 198.5
[M]+ 374.17773 190.3
[M]- 374.17883 190.3
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.