CID 12817187

Amino(methoxy) sulfanylidenephosphinite

Structural Information

Molecular Formula

SMILES

COP(=S)(N)O

InChI

InChI=1S/CH6NO2PS/c1-4-5(2,3)6/h1H3,(H3,2,3,6)

InChIKey

WPEVVXOGSYZQDP-UHFFFAOYSA-N

Compound name

[amino(hydroxy)phosphinothioyl]oxymethane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 25
Patents: 126.98569 Da
Monoisotopic Mass: -0.1
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]+	127.99297	121.5
[M+Na]+	149.97491	129.4
[M-H]-	125.97841	119.5
[M+NH4]+	145.01951	143.4
[M+K]+	165.94885	128.2
[M+H-H2O]+	109.98295	115.0
[M+HCOO]-	171.98389	144.7
[M+CH3COO]-	185.99954	167.7
[M+Na-2H]-	147.96036	123.4
[M]+	126.98514	122.1
[M]-	126.98624	122.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe