CID 200651

Brn 1798954

Structural Information

Molecular Formula
C7H15N2O4PS2
SMILES
CCOP(=S)(OCC)SCC(=O)NC(=O)N
InChI
InChI=1S/C7H15N2O4PS2/c1-3-12-14(15,13-4-2)16-5-6(10)9-7(8)11/h3-5H2,1-2H3,(H3,8,9,10,11)
InChIKey
XYKRSZGFPADKEN-UHFFFAOYSA-N
Compound name
N-carbamoyl-2-diethoxyphosphinothioylsulfanylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.0211 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.02838 160.5
[M+Na]+ 309.01032 163.7
[M+NH4]+ 304.05492 164.7
[M+K]+ 324.98426 158.8
[M-H]- 285.01382 157.1
[M+Na-2H]- 306.99577 158.9
[M]+ 286.02055 160.1
[M]- 286.02165 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.