CID 4095310

63018-93-9

Structural Information

Molecular Formula
C30H20
SMILES
C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=CC=CC=C42)C5=CC=CC6=CC=CC=C65
InChI
InChI=1S/C30H20/c1-2-12-22(13-3-1)29-25-16-6-8-18-27(25)30(28-19-9-7-17-26(28)29)24-20-10-14-21-11-4-5-15-23(21)24/h1-20H
InChIKey
HICWKUFWPIBTCN-UHFFFAOYSA-N
Compound name
9-naphthalen-1-yl-10-phenylanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

242
Patents

380.1565 Da
Monoisotopic Mass

8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.16378 195.3
[M+Na]+ 403.14572 204.1
[M-H]- 379.14922 206.8
[M+NH4]+ 398.19032 208.6
[M+K]+ 419.11966 194.3
[M+H-H2O]+ 363.15376 182.8
[M+HCOO]- 425.15470 214.6
[M+CH3COO]- 439.17035 205.0
[M+Na-2H]- 401.13117 202.8
[M]+ 380.15595 194.6
[M]- 380.15705 194.6
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