CID 83376

Sodium diisobutyldithiophosphinate

Structural Information

Molecular Formula

C₈H₁₉PS₂

SMILES

CC(C)CP(=S)(CC(C)C)S

InChI

InChI=1S/C8H19PS2/c1-7(2)5-9(10,11)6-8(3)4/h7-8H,5-6H2,1-4H3,(H,10,11)

InChIKey

PTZADPBANVYSTR-UHFFFAOYSA-N

Compound name

bis(2-methylpropyl)-sulfanyl-sulfanylidene-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 304
Patents: 210.06657 Da
Monoisotopic Mass: 4.2
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]+	211.07385	143.2
[M+Na]+	233.05579	148.9
[M-H]-	209.05929	142.2
[M+NH4]+	228.10039	163.3
[M+K]+	249.02973	146.2
[M+H-H2O]+	193.06383	135.6
[M+HCOO]-	255.06477	157.3
[M+CH3COO]-	269.08042	190.0
[M+Na-2H]-	231.04124	138.6
[M]+	210.06602	146.7
[M]-	210.06712	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe