CID 126843514

Glycolaldehyde triphosphate

Structural Information

Molecular Formula
C2H7O11P3
SMILES
C(C=O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O
InChI
InChI=1S/C2H7O11P3/c3-1-2-11-15(7,8)13-16(9,10)12-14(4,5)6/h1H,2H2,(H,7,8)(H,9,10)(H2,4,5,6)
InChIKey
YCHNXNZRJSWRAB-UHFFFAOYSA-N
Compound name
[hydroxy(2-oxoethoxy)phosphoryl] phosphono hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

0
Patents

299.92014 Da
Monoisotopic Mass

-4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.92742 162.6
[M+Na]+ 322.90936 163.0
[M-H]- 298.91286 165.3
[M+NH4]+ 317.95396 164.5
[M+K]+ 338.88330 150.4
[M+H-H2O]+ 282.91740 137.2
[M+HCOO]- 344.91834 183.8
[M+CH3COO]- 358.93399 188.8
[M+Na-2H]- 320.89481 148.8
[M]+ 299.91959 159.6
[M]- 299.92069 159.6
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.