CID 22020377

1,3-bis(n-carbazolyl)benzene

Structural Information

Molecular Formula
C30H20N2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC(=CC=C4)N5C6=CC=CC=C6C7=CC=CC=C75
InChI
InChI=1S/C30H20N2/c1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-20H
InChIKey
MZYDBGLUVPLRKR-UHFFFAOYSA-N
Compound name
9-(3-carbazol-9-ylphenyl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22437
Patents

408.16266 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.16994 200.9
[M+Na]+ 431.15188 213.4
[M-H]- 407.15538 213.1
[M+NH4]+ 426.19648 215.5
[M+K]+ 447.12582 202.7
[M+H-H2O]+ 391.15992 189.4
[M+HCOO]- 453.16086 221.8
[M+CH3COO]- 467.17651 211.6
[M+Na-2H]- 429.13733 205.1
[M]+ 408.16211 205.3
[M]- 408.16321 205.3
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

patents stripe