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]+ 463.216876 214.1
[M+Na]+ 485.198818 218.5
[M-H]- 461.202324 228.4
[M+NH4]+ 480.243423 220.5
[M+K]+ 501.172758 208.5
[M+H-H2O]+ 445.206860 200.1
[M+HCOO]- 507.207801 235.5
[M+CH3COO]- 521.223451 221.2
[M+Na-2H]- 483.184266 219.4
[M]+ 462.20905142 209.9
[M]- 462.21014858 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.