CID 213450

26350-31-2

Structural Information

Molecular Formula

C₃H₁₀NPS₂

SMILES

CCP(=S)(N)SC

InChI

InChI=1S/C3H10NPS2/c1-3-5(4,6)7-2/h3H2,1-2H3,(H2,4,6)

InChIKey

XEOUWRVMEZHTAD-UHFFFAOYSA-N

Compound name

[amino(methylsulfanyl)phosphinothioyl]ethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 154.99922 Da
Monoisotopic Mass: 1.2
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]+	156.00650	126.2
[M+Na]+	177.98844	133.7
[M-H]-	153.99194	125.1
[M+NH4]+	173.03304	147.8
[M+K]+	193.96238	130.5
[M+H-H2O]+	137.99648	118.8
[M+HCOO]-	199.99742	144.1
[M+CH3COO]-	214.01307	177.4
[M+Na-2H]-	175.97389	125.1
[M]+	154.99867	127.0
[M]-	154.99977	127.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe