CID 86277918

Hydroxypyridine tartrate

Structural Information

Molecular Formula
C9H9NO6
SMILES
C1=CC(=CN=C1)OC(=O)[C@@H]([C@H](C(=O)O)O)O
InChI
InChI=1S/C9H9NO6/c11-6(8(13)14)7(12)9(15)16-5-2-1-3-10-4-5/h1-4,6-7,11-12H,(H,13,14)/t6-,7-/m1/s1
InChIKey
KJAYUZVBMKIAGE-RNFRBKRXSA-N
Compound name
(2R,3R)-2,3-dihydroxy-4-oxo-4-pyridin-3-yloxybutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.04298 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.050256 145.1
[M+Na]+ 250.032198 150.2
[M-H]- 226.035704 143.2
[M+NH4]+ 245.076803 158.8
[M+K]+ 266.006138 149.8
[M+H-H2O]+ 210.040240 138.5
[M+HCOO]- 272.041181 161.5
[M+CH3COO]- 286.056831 180.4
[M+Na-2H]- 248.017646 147.1
[M]+ 227.04243142 144.5
[M]- 227.04352858 144.5
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

No patent data available for this compound.