CID 12173629

2,8-dibromoindeno[1,2-b]fluorene-6,12-dione

Structural Information

Molecular Formula
C20H8Br2O2
SMILES
C1=CC2=C(C=C1Br)C(=O)C3=CC4=C(C=C23)C(=O)C5=C4C=CC(=C5)Br
InChI
InChI=1S/C20H8Br2O2/c21-9-1-3-11-13-7-18-14(8-17(13)19(23)15(11)5-9)12-4-2-10(22)6-16(12)20(18)24/h1-8H
InChIKey
PFFSYBJLQOJRQU-UHFFFAOYSA-N
Compound name
2,8-dibromoindeno[1,2-b]fluorene-6,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

437.8891 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.89638 182.4
[M+Na]+ 460.87832 197.8
[M-H]- 436.88182 194.0
[M+NH4]+ 455.92292 203.5
[M+K]+ 476.85226 183.6
[M+H-H2O]+ 420.88636 191.4
[M+HCOO]- 482.88730 199.9
[M+CH3COO]- 496.90295 196.7
[M+Na-2H]- 458.86377 187.3
[M]+ 437.88855 221.5
[M]- 437.88965 221.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe