CID 6439684

2984-80-7

Structural Information

Molecular Formula
C10H10Br2ClO4P
SMILES
COP(=O)(OC)O/C(=C/Cl)/C1=C(C=C(C=C1)Br)Br
InChI
InChI=1S/C10H10Br2ClO4P/c1-15-18(14,16-2)17-10(6-13)8-4-3-7(11)5-9(8)12/h3-6H,1-2H3/b10-6+
InChIKey
DLXQLRVYDCPGJX-UXBLZVDNSA-N
Compound name
[(E)-2-chloro-1-(2,4-dibromophenyl)ethenyl] dimethyl phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

417.8372 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 418.84448 175.9
[M+Na]+ 440.82642 187.7
[M-H]- 416.82992 182.0
[M+NH4]+ 435.87102 192.6
[M+K]+ 456.80036 170.9
[M+H-H2O]+ 400.83446 182.1
[M+HCOO]- 462.83540 190.7
[M+CH3COO]- 476.85105 217.1
[M+Na-2H]- 438.81187 178.2
[M]+ 417.83665 214.9
[M]- 417.83775 214.9
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.