CID 284455

Phosphinic acid, bis(o-bromophenyl)-

Structural Information

Molecular Formula
C12H9Br2O2P
SMILES
C1=CC=C(C(=C1)P(=O)(C2=CC=CC=C2Br)O)Br
InChI
InChI=1S/C12H9Br2O2P/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14/h1-8H,(H,15,16)
InChIKey
MLQXYNWMVSKFPP-UHFFFAOYSA-N
Compound name
bis(2-bromophenyl)phosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

373.8707 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.87798 174.6
[M+Na]+ 396.85992 184.7
[M-H]- 372.86342 181.8
[M+NH4]+ 391.90452 190.9
[M+K]+ 412.83386 168.9
[M+H-H2O]+ 356.86796 180.5
[M+HCOO]- 418.86890 192.6
[M+CH3COO]- 432.88455 211.2
[M+Na-2H]- 394.84537 177.7
[M]+ 373.87015 208.2
[M]- 373.87125 208.2
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