CID 137063

9,9'-bifluorene

Structural Information

Molecular Formula
C26H18
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)C4C5=CC=CC=C5C6=CC=CC=C46
InChI
InChI=1S/C26H18/c1-5-13-21-17(9-1)18-10-2-6-14-22(18)25(21)26-23-15-7-3-11-19(23)20-12-4-8-16-24(20)26/h1-16,25-26H
InChIKey
QXAIDADUIMVTPS-UHFFFAOYSA-N
Compound name
9-(9H-fluoren-9-yl)-9H-fluorene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

886
Patents

330.14084 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.14812 179.7
[M+Na]+ 353.13006 189.7
[M-H]- 329.13356 190.6
[M+NH4]+ 348.17466 200.8
[M+K]+ 369.10400 180.6
[M+H-H2O]+ 313.13810 171.7
[M+HCOO]- 375.13904 200.1
[M+CH3COO]- 389.15469 191.6
[M+Na-2H]- 351.11551 182.7
[M]+ 330.14029 180.4
[M]- 330.14139 180.4
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