CID 2778008

59609-07-3

Structural Information

Molecular Formula
C11H22O6P2
SMILES
CC1(COP(=O)(OC1)CP2(=O)OCC(CO2)(C)C)C
InChI
InChI=1S/C11H22O6P2/c1-10(2)5-14-18(12,15-6-10)9-19(13)16-7-11(3,4)8-17-19/h5-9H2,1-4H3
InChIKey
SBBDXNPCMKYRSF-UHFFFAOYSA-N
Compound name
2-[(5,5-dimethyl-2-oxo-1,3,2lambda5-dioxaphosphinan-2-yl)methyl]-5,5-dimethyl-1,3,2lambda5-dioxaphosphinane 2-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

312.08917 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.09645 165.4
[M+Na]+ 335.07839 172.2
[M-H]- 311.08189 172.0
[M+NH4]+ 330.12299 183.1
[M+K]+ 351.05233 177.8
[M+H-H2O]+ 295.08643 157.0
[M+HCOO]- 357.08737 189.5
[M+CH3COO]- 371.10302 203.3
[M+Na-2H]- 333.06384 170.8
[M]+ 312.08862 169.6
[M]- 312.08972 169.6
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.