CID 22987624

2-deoxy-ribonic acid

Structural Information

Molecular Formula
C5H10O5
SMILES
C(CO)C(C(C(=O)O)O)O
InChI
InChI=1S/C5H10O5/c6-2-1-3(7)4(8)5(9)10/h3-4,6-8H,1-2H2,(H,9,10)
InChIKey
SJXSBTISVFRFLJ-UHFFFAOYSA-N
Compound name
2,3,5-trihydroxypentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

150.05283 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.06011 130.7
[M+Na]+ 173.04205 136.0
[M-H]- 149.04555 125.5
[M+NH4]+ 168.08665 148.7
[M+K]+ 189.01599 135.6
[M+H-H2O]+ 133.05009 126.5
[M+HCOO]- 195.05103 147.1
[M+CH3COO]- 209.06668 165.9
[M+Na-2H]- 171.02750 132.2
[M]+ 150.05228 128.5
[M]- 150.05338 128.5
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

patents stripe