CID 14035690

Prcp

Structural Information

Molecular Formula
C5H10O10P2
SMILES
C([C@@H]1[C@H]([C@@H]2[C@H](O1)OP(=O)(O2)O)O)OP(=O)(O)O
InChI
InChI=1S/C5H10O10P2/c6-3-2(1-12-16(7,8)9)13-5-4(3)14-17(10,11)15-5/h2-6H,1H2,(H,10,11)(H2,7,8,9)/t2-,3-,4-,5-/m1/s1
InChIKey
OXGUIUWFXGIWNM-TXICZTDVSA-N
Compound name
[(3aR,5R,6R,6aR)-2,6-dihydroxy-2-oxo-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3,2]dioxaphosphol-5-yl]methyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

291.9749 Da
Monoisotopic Mass

-3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.98218 154.2
[M+Na]+ 314.96412 160.5
[M-H]- 290.96762 153.0
[M+NH4]+ 310.00872 169.7
[M+K]+ 330.93806 164.1
[M+H-H2O]+ 274.97216 148.5
[M+HCOO]- 336.97310 178.0
[M+CH3COO]- 350.98875 188.4
[M+Na-2H]- 312.94957 158.4
[M]+ 291.97435 158.7
[M]- 291.97545 158.7
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.