CID 24840012

Mercury, (2,4-dibromo-6-((p-bromophenyl)carbamoyl)phenoxy)phenyl-

Structural Information

Molecular Formula
C19H12Br3HgNO2
SMILES
C1=CC=C(C=C1)[Hg]OC2=C(C=C(C=C2Br)Br)C(=O)NC3=CC=C(C=C3)Br
InChI
InChI=1S/C13H8Br3NO2.C6H5.Hg/c14-7-1-3-9(4-2-7)17-13(19)10-5-8(15)6-11(16)12(10)18;1-2-4-6-5-3-1;/h1-6,18H,(H,17,19);1-5H;/q;;+1/p-1
InChIKey
PJBMRDBETFOHRU-UHFFFAOYSA-M
Compound name
[2,4-dibromo-6-[(4-bromophenyl)carbamoyl]phenoxy]-phenylmercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

724.81244 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 725.81972 200.1
[M+Na]+ 747.80166 204.0
[M-H]- 723.80516 207.1
[M+NH4]+ 742.84626 208.7
[M+K]+ 763.77560 189.1
[M+H-H2O]+ 707.80970 211.9
[M+HCOO]- 769.81064 208.2
[M+CH3COO]- 783.82629 242.5
[M+Na-2H]- 745.78711 199.7
[M]+ 724.81189 240.4
[M]- 724.81299 240.4
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.