CID 80268

2,4-dichlorophenyl dimethyl phosphate

Structural Information

Molecular Formula
C8H9Cl2O4P
SMILES
COP(=O)(OC)OC1=C(C=C(C=C1)Cl)Cl
InChI
InChI=1S/C8H9Cl2O4P/c1-12-15(11,13-2)14-8-4-3-6(9)5-7(8)10/h3-5H,1-2H3
InChIKey
HQOXGGXIWGFFQY-UHFFFAOYSA-N
Compound name
(2,4-dichlorophenyl) dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.96155 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.96883 147.9
[M+Na]+ 292.95077 158.9
[M-H]- 268.95427 151.1
[M+NH4]+ 287.99537 166.9
[M+K]+ 308.92471 155.7
[M+H-H2O]+ 252.95881 142.3
[M+HCOO]- 314.95975 167.9
[M+CH3COO]- 328.97540 193.6
[M+Na-2H]- 290.93622 151.9
[M]+ 269.96100 157.4
[M]- 269.96210 157.4
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.