CID 200770

Brn 2268539

Structural Information

Molecular Formula
C10H23FNO2PS2
SMILES
CCN(CCF)CCSP(=S)(OCC)OCC
InChI
InChI=1S/C10H23FNO2PS2/c1-4-12(8-7-11)9-10-17-15(16,13-5-2)14-6-3/h4-10H2,1-3H3
InChIKey
VOGCTRQKSIRARW-UHFFFAOYSA-N
Compound name
N-(2-diethoxyphosphinothioylsulfanylethyl)-N-ethyl-2-fluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.08917 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.09645 164.6
[M+Na]+ 326.07839 168.7
[M-H]- 302.08189 162.6
[M+NH4]+ 321.12299 181.0
[M+K]+ 342.05233 166.0
[M+H-H2O]+ 286.08643 154.2
[M+HCOO]- 348.08737 180.9
[M+CH3COO]- 362.10302 208.7
[M+Na-2H]- 324.06384 161.1
[M]+ 303.08862 171.8
[M]- 303.08972 171.8
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.