CID 58743144

2-bromo-7-chloro-9,9-dimethyl-9h-fluorene

Structural Information

Molecular Formula
C15H12BrCl
SMILES
CC1(C2=C(C=CC(=C2)Cl)C3=C1C=C(C=C3)Br)C
InChI
InChI=1S/C15H12BrCl/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
GTKHJVYKTOLTPB-UHFFFAOYSA-N
Compound name
2-bromo-7-chloro-9,9-dimethylfluorene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

134
Patents

305.98108 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.98836 162.8
[M+Na]+ 328.97030 179.0
[M-H]- 304.97380 171.8
[M+NH4]+ 324.01490 189.0
[M+K]+ 344.94424 164.6
[M+H-H2O]+ 288.97834 164.7
[M+HCOO]- 350.97928 179.1
[M+CH3COO]- 364.99493 178.6
[M+Na-2H]- 326.95575 169.5
[M]+ 305.98053 185.4
[M]- 305.98163 185.4
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