CID 155820603

1,2-dibromo-1-(dimethylphosphoryl)ethane

Structural Information

Molecular Formula

C₄H₉Br₂OP

SMILES

CP(=O)(C)C(CBr)Br

InChI

InChI=1S/C4H9Br2OP/c1-8(2,7)4(6)3-5/h4H,3H2,1-2H3

InChIKey

ZTDXYSOWDWUGTA-UHFFFAOYSA-N

Compound name

1,2-dibromo-1-dimethylphosphorylethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 261.8758 Da
Monoisotopic Mass: 1.1
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]+	262.88308	152.8
[M+Na]+	284.86502	164.0
[M-H]-	260.86852	156.3
[M+NH4]+	279.90962	173.5
[M+K]+	300.83896	148.5
[M+H-H2O]+	244.87306	159.3
[M+HCOO]-	306.87400	170.9
[M+CH3COO]-	320.88965	199.3
[M+Na-2H]-	282.85047	156.4
[M]+	261.87525	187.3
[M]-	261.87635	187.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.