CID 49859616

5-fluoro-5-deoxy-d-ribose 1-phosphate

Structural Information

Molecular Formula
C5H10FO7P
SMILES
C([C@@H]1[C@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)F
InChI
InChI=1S/C5H10FO7P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-5,7-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
InChIKey
LUQFMENCTWEBSQ-TXICZTDVSA-N
Compound name
[(2R,3R,4S,5S)-5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl] dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

232.01482 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.022096 143.7
[M+Na]+ 255.004038 150.7
[M-H]- 231.007544 140.3
[M+NH4]+ 250.048643 159.8
[M+K]+ 270.977978 150.8
[M+H-H2O]+ 215.012080 136.8
[M+HCOO]- 277.013021 164.2
[M+CH3COO]- 291.028671 178.1
[M+Na-2H]- 252.989486 144.7
[M]+ 232.01427142 143.1
[M]- 232.01536858 143.1
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.