CID 89142

21998-73-2

Structural Information

Molecular Formula
C11H27NO5P2S2
SMILES
CC(C)OP(=O)(N(C)CCSP(=S)(OC)OC)OC(C)C
InChI
InChI=1S/C11H27NO5P2S2/c1-10(2)16-18(13,17-11(3)4)12(5)8-9-21-19(20,14-6)15-7/h10-11H,8-9H2,1-7H3
InChIKey
XORKDXPRPPOFPV-UHFFFAOYSA-N
Compound name
2-dimethoxyphosphinothioylsulfanyl-N-di(propan-2-yloxy)phosphoryl-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

379.0806 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.08788 180.3
[M+Na]+ 402.06982 182.9
[M+NH4]+ 397.11442 183.8
[M+K]+ 418.04376 179.2
[M-H]- 378.07332 175.9
[M+Na-2H]- 400.05527 178.2
[M]+ 379.08005 179.8
[M]- 379.08115 179.8
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.