CID 3083110

3brphn sbcl6

Structural Information

Molecular Formula
C24H16Br4N
SMILES
C1=CC(=CC=C1[N+](C2=CC=C(C=C2)Br)(C3=CC=C(C=C3)Br)C4=CC=C(C=C4)Br)Br
InChI
InChI=1S/C24H16Br4N/c25-17-1-9-21(10-2-17)29(22-11-3-18(26)4-12-22,23-13-5-19(27)6-14-23)24-15-7-20(28)8-16-24/h1-16H/q+1
InChIKey
AAILCTMXQKQMFC-UHFFFAOYSA-N
Compound name
tetrakis(4-bromophenyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

5
Patents

633.80164 Da
Monoisotopic Mass

9.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 634.80892 197.3
[M+Na]+ 656.79086 200.6
[M-H]- 632.79436 203.9
[M+NH4]+ 651.83546 204.1
[M+K]+ 672.76480 187.9
[M+H-H2O]+ 616.79890 215.2
[M+HCOO]- 678.79984 201.8
[M+CH3COO]- 692.81549 246.6
[M+Na-2H]- 654.77631 197.2
[M]+ 633.80109 234.8
[M]- 633.80219 234.8
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

patents stripe