CID 52306

73728-54-8

Structural Information

Molecular Formula
C13H8Br4N2
SMILES
C1C2=C(C(=C(C=C2C3=CC(=C(C(=C31)Br)N)Br)Br)N)Br
InChI
InChI=1S/C13H8Br4N2/c14-8-2-4-5-3-9(15)13(19)11(17)7(5)1-6(4)10(16)12(8)18/h2-3H,1,18-19H2
InChIKey
ZCAISNYEBGQMEE-UHFFFAOYSA-N
Compound name
1,3,6,8-tetrabromo-9H-fluorene-2,7-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

507.7421 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 508.74938 167.7
[M+Na]+ 530.73132 173.5
[M-H]- 506.73482 171.8
[M+NH4]+ 525.77592 177.7
[M+K]+ 546.70526 160.4
[M+H-H2O]+ 490.73936 184.0
[M+HCOO]- 552.74030 172.8
[M+CH3COO]- 566.75595 174.1
[M+Na-2H]- 528.71677 167.9
[M]+ 507.74155 204.8
[M]- 507.74265 204.8
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

No patent data available for this compound.