CID 170900385

2897656-97-0

Structural Information

Molecular Formula
C34H26N2
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C=C2)NC4=CC=CC=C4NC5=CC=CC=C5C6=CC=CC=C6
InChI
InChI=1S/C34H26N2/c1-3-13-25(14-4-1)28-18-9-10-20-31(28)35-32-21-11-12-22-33(32)36-34-29-19-8-7-17-27(29)23-24-30(34)26-15-5-2-6-16-26/h1-24,35-36H
InChIKey
XDBPZHWQLWXPJP-UHFFFAOYSA-N
Compound name
2-N-(2-phenylnaphthalen-1-yl)-1-N-(2-phenylphenyl)benzene-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

462.2096 Da
Monoisotopic Mass

9.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 463.21688 214.1
[M+Na]+ 485.19882 218.5
[M-H]- 461.20232 228.4
[M+NH4]+ 480.24342 220.5
[M+K]+ 501.17276 208.5
[M+H-H2O]+ 445.20686 200.1
[M+HCOO]- 507.20780 235.5
[M+CH3COO]- 521.22345 221.2
[M+Na-2H]- 483.18427 219.4
[M]+ 462.20905 209.9
[M]- 462.21015 209.9
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.