CID 172407964

Chebi:232393

Structural Information

Molecular Formula
C7H15O9P
SMILES
C([C@H](COP(=O)(O)OC[C@H](COC=O)O)O)O
InChI
InChI=1S/C7H15O9P/c8-1-6(10)3-15-17(12,13)16-4-7(11)2-14-5-9/h5-8,10-11H,1-4H2,(H,12,13)/t6-,7+/m1/s1
InChIKey
NYPAQEAQEOGEDF-RQJHMYQMSA-N
Compound name
[(2S)-3-[[(2R)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-hydroxypropyl] formate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.04538 Da
Monoisotopic Mass

-3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.05266 157.1
[M+Na]+ 297.03460 160.1
[M+NH4]+ 292.07920 170.5
[M+K]+ 313.00854 161.9
[M-H]- 273.03810 148.7
[M+Na-2H]- 295.02005 153.3
[M]+ 274.04483 154.0
[M]- 274.04593 154.0
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.