CID 36702

Acetyl chloride, dichlorophosphono-

Structural Information

Molecular Formula

C₂H₂Cl₃O₂P

SMILES

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

InChI

InChI=1S/C2H2Cl3O2P/c3-2(6)1-8(4,5)7/h1H2

InChIKey

FVLMLHKNLUAVNE-UHFFFAOYSA-N

Compound name

2-dichlorophosphorylacetyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 193.8858 Da
Monoisotopic Mass: 1.5
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]+	194.89308	127.4
[M+Na]+	216.87502	138.0
[M-H]-	192.87852	126.4
[M+NH4]+	211.91962	148.8
[M+K]+	232.84896	133.9
[M+H-H2O]+	176.88306	124.7
[M+HCOO]-	238.88400	141.1
[M+CH3COO]-	252.89965	179.9
[M+Na-2H]-	214.86047	131.0
[M]+	193.88525	131.8
[M]-	193.88635	131.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe