CID 6107844

Methylbromfenvinphos, e-

Structural Information

Molecular Formula

C₁₀H₁₀BrCl₂O₄P

SMILES

COP(=O)(OC)O/C(=C/Br)/C1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C10H10BrCl2O4P/c1-15-18(14,16-2)17-10(6-11)8-4-3-7(12)5-9(8)13/h3-6H,1-2H3/b10-6+

InChIKey

LOOAGTDYKNUDBZ-UXBLZVDNSA-N

Compound name

[(E)-2-bromo-1-(2,4-dichlorophenyl)ethenyl] dimethyl phosphate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 24
References: 9
Patents: 373.8877 Da
Monoisotopic Mass: 2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	374.89498	170.6
[M+Na]+	396.87692	184.2
[M-H]-	372.88042	176.1
[M+NH4]+	391.92152	189.1
[M+K]+	412.85086	171.0
[M+H-H2O]+	356.88496	170.1
[M+HCOO]-	418.88590	186.5
[M+CH3COO]-	432.90155	207.3
[M+Na-2H]-	394.86237	173.2
[M]+	373.88715	196.9
[M]-	373.88825	196.9

Literature stripe

literature stripe

Patent stripe

patents stripe