CID 258744

1,3,6,8-tetrabromocarbazole

Structural Information

Molecular Formula
C12H5Br4N
SMILES
C1=C(C=C(C2=C1C3=C(N2)C(=CC(=C3)Br)Br)Br)Br
InChI
InChI=1S/C12H5Br4N/c13-5-1-7-8-2-6(14)4-10(16)12(8)17-11(7)9(15)3-5/h1-4,17H
InChIKey
FNHISDQCWYSMTO-UHFFFAOYSA-N
Compound name
1,3,6,8-tetrabromo-9H-carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

34
Patents

478.71555 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 479.72283 152.7
[M+Na]+ 501.70477 159.7
[M-H]- 477.70827 157.0
[M+NH4]+ 496.74937 163.5
[M+K]+ 517.67871 147.8
[M+H-H2O]+ 461.71281 171.7
[M+HCOO]- 523.71375 158.3
[M+CH3COO]- 537.72940 160.6
[M+Na-2H]- 499.69022 155.8
[M]+ 478.71500 191.7
[M]- 478.71610 191.7
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