CID 94516

41203-81-0

Structural Information

Molecular Formula
C9H20O6P2
SMILES
CCC1(COP(=O)(OC1)C)COP(=O)(C)OC
InChI
InChI=1S/C9H20O6P2/c1-5-9(6-13-16(3,10)12-2)7-14-17(4,11)15-8-9/h5-8H2,1-4H3
InChIKey
CFIFBLCPLCPITL-UHFFFAOYSA-N
Compound name
5-ethyl-5-[[methoxy(methyl)phosphoryl]oxymethyl]-2-methyl-1,3,2lambda5-dioxaphosphinane 2-oxide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

210
Patents

286.07352 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.08080 159.9
[M+Na]+ 309.06274 167.6
[M+NH4]+ 304.10734 167.2
[M+K]+ 325.03668 162.2
[M-H]- 285.06624 160.3
[M+Na-2H]- 307.04819 163.5
[M]+ 286.07297 161.0
[M]- 286.07407 161.0
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

patents stripe