CID 16217884

2,7-bis(bromomethyl)-9,9-dihexyl-9h-fluorene

Structural Information

Molecular Formula
C27H36Br2
SMILES
CCCCCCC1(C2=C(C=CC(=C2)CBr)C3=C1C=C(C=C3)CBr)CCCCCC
InChI
InChI=1S/C27H36Br2/c1-3-5-7-9-15-27(16-10-8-6-4-2)25-17-21(19-28)11-13-23(25)24-14-12-22(20-29)18-26(24)27/h11-14,17-18H,3-10,15-16,19-20H2,1-2H3
InChIKey
SVNIUQSXMPTBFB-UHFFFAOYSA-N
Compound name
2,7-bis(bromomethyl)-9,9-dihexylfluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

518.1184 Da
Monoisotopic Mass

11.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 519.12568 206.9
[M+Na]+ 541.10762 201.6
[M+NH4]+ 536.15222 209.5
[M+K]+ 557.08156 203.7
[M-H]- 517.11112 208.3
[M+Na-2H]- 539.09307 205.7
[M]+ 518.11785 205.7
[M]- 518.11895 205.7
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