CID 380394

Nsc665911

Structural Information

Molecular Formula
C18H33ClO5P2Sn
SMILES
CCOP(=O)(C1=CC=CC=C1)C(C[Sn](C)(C)Cl)P(=O)(OC(C)C)OC(C)C
InChI
InChI=1S/C16H27O5P2.2CH3.ClH.Sn/c1-7-19-22(17,16-11-9-8-10-12-16)15(6)23(18,20-13(2)3)21-14(4)5;;;;/h8-15H,6-7H2,1-5H3;2*1H3;1H;/q;;;;+1/p-1
InChIKey
KPFQMVJPXNAAMB-UHFFFAOYSA-M
Compound name
chloro-[2-di(propan-2-yloxy)phosphoryl-2-[ethoxy(phenyl)phosphoryl]ethyl]-dimethylstannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

546.0514 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 547.05868 226.6
[M+Na]+ 569.04062 229.5
[M-H]- 545.04412 226.7
[M+NH4]+ 564.08522 215.2
[M+K]+ 585.01456 227.3
[M+H-H2O]+ 529.04866 215.6
[M+HCOO]- 591.04960 222.9
[M+CH3COO]- 605.06525 234.6
[M+Na-2H]- 567.02607 222.2
[M]+ 546.05085 237.5
[M]- 546.05195 237.5
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.