CID 12123876

2,7-dibromo-9,9-dimethylfluorene

Structural Information

Molecular Formula
C15H12Br2
SMILES
CC1(C2=C(C=CC(=C2)Br)C3=C1C=C(C=C3)Br)C
InChI
InChI=1S/C15H12Br2/c1-15(2)13-7-9(16)3-5-11(13)12-6-4-10(17)8-14(12)15/h3-8H,1-2H3
InChIKey
LONBOJIXBFUBKQ-UHFFFAOYSA-N
Compound name
2,7-dibromo-9,9-dimethylfluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1196
Patents

349.93057 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.93785 160.5
[M+Na]+ 372.91979 173.6
[M-H]- 348.92329 169.5
[M+NH4]+ 367.96439 183.2
[M+K]+ 388.89373 158.2
[M+H-H2O]+ 332.92783 169.9
[M+HCOO]- 394.92877 176.0
[M+CH3COO]- 408.94442 174.9
[M+Na-2H]- 370.90524 167.0
[M]+ 349.93002 196.1
[M]- 349.93112 196.1
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