CID 130124961

2-hydroxy-5,5-bis(hydroxymethyl)-1,3,2-dioxaphosphinane 2-oxide

Structural Information

Molecular Formula
C5H11O6P
SMILES
C1C(COP(=O)(O1)O)(CO)CO
InChI
InChI=1S/C5H11O6P/c6-1-5(2-7)3-10-12(8,9)11-4-5/h6-7H,1-4H2,(H,8,9)
InChIKey
KFIYKCOAYASSIT-UHFFFAOYSA-N
Compound name
[2-hydroxy-5-(hydroxymethyl)-2-oxo-1,3,2lambda5-dioxaphosphinan-5-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.02933 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.03661 139.1
[M+Na]+ 221.01855 146.1
[M-H]- 197.02205 139.0
[M+NH4]+ 216.06315 158.0
[M+K]+ 236.99249 147.9
[M+H-H2O]+ 181.02659 133.6
[M+HCOO]- 243.02753 160.7
[M+CH3COO]- 257.04318 172.4
[M+Na-2H]- 219.00400 145.7
[M]+ 198.02878 139.7
[M]- 198.02988 139.7
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.