CID 5063078

Methylenebis(phosphonic dichloride)

Structural Information

Molecular Formula

CH₂Cl₄O₂P₂

SMILES

C(P(=O)(Cl)Cl)P(=O)(Cl)Cl

InChI

InChI=1S/CH2Cl4O2P2/c2-8(3,6)1-9(4,5)7/h1H2

InChIKey

VRXYCDTWIOCJBH-UHFFFAOYSA-N

Compound name

bis(dichlorophosphoryl)methane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 244
Patents: 247.82841 Da
Monoisotopic Mass: 1.8
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]+	248.83569	138.0
[M+Na]+	270.81763	149.1
[M-H]-	246.82113	135.6
[M+NH4]+	265.86223	157.6
[M+K]+	286.79157	144.1
[M+H-H2O]+	230.82567	134.2
[M+HCOO]-	292.82661	150.5
[M+CH3COO]-	306.84226	189.9
[M+Na-2H]-	268.80308	140.7
[M]+	247.82786	142.5
[M]-	247.82896	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe