CID 452959

134720-14-2

Structural Information

Molecular Formula
C11H13N3O2
SMILES
C1C[C@@H](O[C@@H]1CO)N2C=NC3=C2N=CC=C3
InChI
InChI=1S/C11H13N3O2/c15-6-8-3-4-10(16-8)14-7-13-9-2-1-5-12-11(9)14/h1-2,5,7-8,10,15H,3-4,6H2/t8-,10+/m0/s1
InChIKey
PNFIPCZMIWKDMY-WCBMZHEXSA-N
Compound name
[(2S,5R)-5-imidazo[4,5-b]pyridin-3-yloxolan-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.10077 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 145.3
[M+Na]+ 242.08999 154.8
[M-H]- 218.09349 149.0
[M+NH4]+ 237.13459 162.3
[M+K]+ 258.06393 152.5
[M+H-H2O]+ 202.09803 137.5
[M+HCOO]- 264.09897 164.7
[M+CH3COO]- 278.11462 158.1
[M+Na-2H]- 240.07544 149.8
[M]+ 219.10022 146.3
[M]- 219.10132 146.3
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.