CID 3066269

Bis(2,5-dichlorophenyl)phosphinic acid

Structural Information

Molecular Formula
C12H7Cl4O2P
SMILES
C1=CC(=C(C=C1Cl)P(=O)(C2=C(C=CC(=C2)Cl)Cl)O)Cl
InChI
InChI=1S/C12H7Cl4O2P/c13-7-1-3-9(15)11(5-7)19(17,18)12-6-8(14)2-4-10(12)16/h1-6H,(H,17,18)
InChIKey
HEDWIBWJVGAWNO-UHFFFAOYSA-N
Compound name
bis(2,5-dichlorophenyl)phosphinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.89377 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.901046 165.6
[M+Na]+ 376.882988 177.1
[M-H]- 352.886494 168.0
[M+NH4]+ 371.927593 180.4
[M+K]+ 392.856928 170.0
[M+H-H2O]+ 336.891030 160.3
[M+HCOO]- 398.891971 172.3
[M+CH3COO]- 412.907621 207.4
[M+Na-2H]- 374.868436 165.5
[M]+ 353.89322142 169.6
[M]- 353.89431858 169.6
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

No patent data available for this compound.