CID 61246

Ethylphosphonothioic dichloride

Structural Information

Molecular Formula

C₂H₅Cl₂PS

SMILES

CCP(=S)(Cl)Cl

InChI

InChI=1S/C2H5Cl2PS/c1-2-5(3,4)6/h2H2,1H3

InChIKey

FRNHPBDNOSCJNW-UHFFFAOYSA-N

Compound name

dichloro-ethyl-sulfanylidene-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

5
Annotation Hits: 0
References: 257
Patents: 161.92267 Da
Monoisotopic Mass: 3.0
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]+	162.92995	122.9
[M+Na]+	184.91189	133.1
[M-H]-	160.91539	123.0
[M+NH4]+	179.95649	146.4
[M+K]+	200.88583	129.0
[M+H-H2O]+	144.91993	119.1
[M+HCOO]-	206.92087	137.2
[M+CH3COO]-	220.93652	174.4
[M+Na-2H]-	182.89734	124.7
[M]+	161.92212	127.3
[M]-	161.92322	127.3

Literature stripe

literature stripe

Patent stripe

patents stripe