CID 668

Dihydroxyacetone phosphate

Structural Information

Molecular Formula
C3H7O6P
SMILES
C(C(=O)COP(=O)(O)O)O
InChI
InChI=1S/C3H7O6P/c4-1-3(5)2-9-10(6,7)8/h4H,1-2H2,(H2,6,7,8)
InChIKey
GNGACRATGGDKBX-UHFFFAOYSA-N
Compound name
(3-hydroxy-2-oxopropyl) dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

6847
References

40394
Patents

169.99803 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.00531 132.4
[M+Na]+ 192.98725 138.7
[M+NH4]+ 188.03185 136.2
[M+K]+ 208.96119 138.4
[M-H]- 168.99075 126.5
[M+Na-2H]- 190.97270 131.9
[M]+ 169.99748 130.9
[M]- 169.99858 130.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe