CID 18775

3348-64-9

Structural Information

Molecular Formula
C4H9O4PS
SMILES
CC(=O)OP(=S)(OC)OC
InChI
InChI=1S/C4H9O4PS/c1-4(5)8-9(10,6-2)7-3/h1-3H3
InChIKey
FXEUYNAEAGTUKO-UHFFFAOYSA-N
Compound name
dimethoxyphosphinothioyl acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.99591 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.00319 134.3
[M+Na]+ 206.98513 142.2
[M-H]- 182.98863 134.1
[M+NH4]+ 202.02973 155.3
[M+K]+ 222.95907 142.7
[M+H-H2O]+ 166.99317 127.4
[M+HCOO]- 228.99411 157.7
[M+CH3COO]- 243.00976 178.5
[M+Na-2H]- 204.97058 135.5
[M]+ 183.99536 141.5
[M]- 183.99646 141.5
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.