CID 182080

Phosphinodithioic acid, dibutyl-, ammonium salt

Structural Information

Molecular Formula

C₈H₁₉PS₂

SMILES

CCCCP(=S)(CCCC)S

InChI

InChI=1S/C8H19PS2/c1-3-5-7-9(10,11)8-6-4-2/h3-8H2,1-2H3,(H,10,11)

InChIKey

MRODDAMGFAPKFW-UHFFFAOYSA-N

Compound name

dibutyl-sulfanyl-sulfanylidene-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 59
Patents: 210.06657 Da
Monoisotopic Mass: 4.1
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]+	211.073846	143.7
[M+Na]+	233.055788	150.1
[M-H]-	209.059294	142.6
[M+NH4]+	228.100393	164.0
[M+K]+	249.029728	146.5
[M+H-H2O]+	193.063830	136.0
[M+HCOO]-	255.064771	160.0
[M+CH3COO]-	269.080421	188.5
[M+Na-2H]-	231.041236	140.9
[M]+	210.06602142	148.3
[M]-	210.06711858	148.3

Literature stripe

literature stripe

Patent stripe

patents stripe