CID 2793751

1498-46-0

Structural Information

Molecular Formula

C₃H₇Cl₂OP

SMILES

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

InChI

InChI=1S/C3H7Cl2OP/c1-3(2)7(4,5)6/h3H,1-2H3

InChIKey

KLHAQQISVPLKAI-UHFFFAOYSA-N

Compound name

2-dichlorophosphorylpropane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 45
Patents: 159.96115 Da
Monoisotopic Mass: 1.7
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]+	160.96843	127.2
[M+Na]+	182.95037	138.8
[M+NH4]+	177.99497	135.6
[M+K]+	198.92431	133.6
[M-H]-	158.95387	125.8
[M+Na-2H]-	180.93582	131.4
[M]+	159.96060	128.9
[M]-	159.96170	128.9

Literature stripe

literature stripe

Patent stripe

patents stripe