CID 4113056

1,8-bis-bromomethyl-fluoren-9-one

Structural Information

Molecular Formula
C15H10Br2O
SMILES
C1=CC(=C2C(=C1)C3=CC=CC(=C3C2=O)CBr)CBr
InChI
InChI=1S/C15H10Br2O/c16-7-9-3-1-5-11-12-6-2-4-10(8-17)14(12)15(18)13(9)11/h1-6H,7-8H2
InChIKey
LFYPLMXUAXINMP-UHFFFAOYSA-N
Compound name
1,8-bis(bromomethyl)fluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

363.90985 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.91713 163.1
[M+Na]+ 386.89907 175.4
[M-H]- 362.90257 171.6
[M+NH4]+ 381.94367 183.6
[M+K]+ 402.87301 159.9
[M+H-H2O]+ 346.90711 171.8
[M+HCOO]- 408.90805 178.6
[M+CH3COO]- 422.92370 177.0
[M+Na-2H]- 384.88452 168.7
[M]+ 363.90930 198.7
[M]- 363.91040 198.7
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