CID 69783

1,2,3,4-tetraphenylnaphthalene

Structural Information

Molecular Formula
C34H24
SMILES
C1=CC=C(C=C1)C2=C(C(=C(C3=CC=CC=C32)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C34H24/c1-5-15-25(16-6-1)31-29-23-13-14-24-30(29)32(26-17-7-2-8-18-26)34(28-21-11-4-12-22-28)33(31)27-19-9-3-10-20-27/h1-24H
InChIKey
UCTTYTFENYGAPP-UHFFFAOYSA-N
Compound name
1,2,3,4-tetraphenylnaphthalene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

208
Patents

432.1878 Da
Monoisotopic Mass

9.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.19508 212.8
[M+Na]+ 455.17702 218.8
[M-H]- 431.18052 227.3
[M+NH4]+ 450.22162 221.0
[M+K]+ 471.15096 208.6
[M+H-H2O]+ 415.18506 198.7
[M+HCOO]- 477.18600 232.1
[M+CH3COO]- 491.20165 220.6
[M+Na-2H]- 453.16247 215.8
[M]+ 432.18725 209.1
[M]- 432.18835 209.1
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

patents stripe