CID 146909956

8-bromo-6-fluoro-2,3,4,9-tetrahydro-1h-carbazole

Structural Information

Molecular Formula
C12H11BrFN
SMILES
C1CCC2=C(C1)C3=C(N2)C(=CC(=C3)F)Br
InChI
InChI=1S/C12H11BrFN/c13-10-6-7(14)5-9-8-3-1-2-4-11(8)15-12(9)10/h5-6,15H,1-4H2
InChIKey
ABCSFWICHWXKQD-UHFFFAOYSA-N
Compound name
8-bromo-6-fluoro-2,3,4,9-tetrahydro-1H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

267.0059 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.01318 154.2
[M+Na]+ 289.99512 167.4
[M-H]- 265.99862 158.9
[M+NH4]+ 285.03972 176.7
[M+K]+ 305.96906 154.2
[M+H-H2O]+ 250.00316 153.9
[M+HCOO]- 312.00410 170.8
[M+CH3COO]- 326.01975 168.3
[M+Na-2H]- 287.98057 160.5
[M]+ 267.00535 169.6
[M]- 267.00645 169.6
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