CID 87048

O,o-dimethyl phosphoramidothioate

Structural Information

Molecular Formula

C₂H₈NO₂PS

SMILES

COP(=S)(N)OC

InChI

InChI=1S/C2H8NO2PS/c1-4-6(3,7)5-2/h1-2H3,(H2,3,7)

InChIKey

NKYPKIVMIGIWOB-UHFFFAOYSA-N

Compound name

[amino(methoxy)phosphinothioyl]oxymethane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 207
Patents: 141.00134 Da
Monoisotopic Mass: 0.5
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]+	142.00862	125.1
[M+Na]+	163.99056	133.1
[M-H]-	139.99406	124.4
[M+NH4]+	159.03516	147.3
[M+K]+	179.96450	132.7
[M+H-H2O]+	123.99860	118.3
[M+HCOO]-	185.99954	149.6
[M+CH3COO]-	200.01519	173.3
[M+Na-2H]-	161.97601	127.1
[M]+	141.00079	128.1
[M]-	141.00189	128.1

Literature stripe

literature stripe

Patent stripe

patents stripe