CID 5326965

Phospholactic acid

Structural Information

Molecular Formula
C3H7O6P
SMILES
C[C@@H](C(=O)O)OP(=O)(O)O
InChI
InChI=1S/C3H7O6P/c1-2(3(4)5)9-10(6,7)8/h2H,1H3,(H,4,5)(H2,6,7,8)/t2-/m0/s1
InChIKey
CSZRNWHGZPKNKY-REOHCLBHSA-N
Compound name
(2S)-2-phosphonooxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

14
References

91
Patents

169.99803 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.00531 132.4
[M+Na]+ 192.98725 138.3
[M+NH4]+ 188.03185 136.1
[M+K]+ 208.96119 138.9
[M-H]- 168.99075 126.3
[M+Na-2H]- 190.97270 131.5
[M]+ 169.99748 130.7
[M]- 169.99858 130.7
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

No patent data available for this compound.