CID 172636048

Chebi:138621

Structural Information

Molecular Formula
C6H9O7P
SMILES
C1[C@H]([C@@H](C(=O)O1)C=O)COP(=O)(O)O
InChI
InChI=1S/C6H9O7P/c7-1-5-4(2-12-6(5)8)3-13-14(9,10)11/h1,4-5H,2-3H2,(H2,9,10,11)/t4-,5-/m0/s1
InChIKey
MUYUCDAUDDGFML-WHFBIAKZSA-N
Compound name
[(3S,4R)-4-formyl-5-oxooxolan-3-yl]methyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.00859 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.01587 141.2
[M+Na]+ 246.99781 148.5
[M-H]- 223.00131 141.7
[M+NH4]+ 242.04241 158.8
[M+K]+ 262.97175 149.3
[M+H-H2O]+ 207.00585 134.9
[M+HCOO]- 269.00679 166.1
[M+CH3COO]- 283.02244 179.9
[M+Na-2H]- 244.98326 144.1
[M]+ 224.00804 144.2
[M]- 224.00914 144.2
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.