CID 11282885

2,2'-dibromo-9,9'-spirobifluorene

Structural Information

Molecular Formula
C25H14Br2
SMILES
C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5C6=C4C=C(C=C6)Br)C=C(C=C3)Br
InChI
InChI=1S/C25H14Br2/c26-15-9-11-19-17-5-1-3-7-21(17)25(23(19)13-15)22-8-4-2-6-18(22)20-12-10-16(27)14-24(20)25/h1-14H
InChIKey
OZZSXAWYZYTWQD-UHFFFAOYSA-N
Compound name
2,2'-dibromo-9,9'-spirobi[fluorene]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

268
Patents

471.94623 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 472.95351 200.7
[M+Na]+ 494.93545 213.1
[M-H]- 470.93895 212.6
[M+NH4]+ 489.98005 221.7
[M+K]+ 510.90939 198.3
[M+H-H2O]+ 454.94349 208.9
[M+HCOO]- 516.94443 214.2
[M+CH3COO]- 530.96008 212.6
[M+Na-2H]- 492.92090 203.7
[M]+ 471.94568 234.9
[M]- 471.94678 234.9
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