CID 89136

21988-63-6

Structural Information

Molecular Formula
C10H25NO5P2S2
SMILES
CC(C)OP(=O)(NCCSP(=S)(OC)OC)OC(C)C
InChI
InChI=1S/C10H25NO5P2S2/c1-9(2)15-17(12,16-10(3)4)11-7-8-20-18(19,13-5)14-6/h9-10H,7-8H2,1-6H3,(H,11,12)
InChIKey
VNQMMLUMPKKRFY-UHFFFAOYSA-N
Compound name
2-dimethoxyphosphinothioylsulfanyl-N-di(propan-2-yloxy)phosphorylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.06494 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.072216 176.8
[M+Na]+ 388.054158 179.1
[M-H]- 364.057664 173.5
[M+NH4]+ 383.098763 199.1
[M+K]+ 404.028098 177.9
[M+H-H2O]+ 348.062200 165.0
[M+HCOO]- 410.063141 208.2
[M+CH3COO]- 424.078791 216.6
[M+Na-2H]- 386.039606 173.4
[M]+ 365.06439142 186.2
[M]- 365.06548858 186.2
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.