CID 3070180

D,l-2-(2'-hydroxy-3'-morpholinopropoxy)imidazo(4,5-b)pyridine oxalate

Structural Information

Molecular Formula
C13H18N4O3
SMILES
C1COCCN1CC(COC2=NC3=C(N2)C=CC=N3)O
InChI
InChI=1S/C13H18N4O3/c18-10(8-17-4-6-19-7-5-17)9-20-13-15-11-2-1-3-14-12(11)16-13/h1-3,10,18H,4-9H2,(H,14,15,16)
InChIKey
UAVHHALGEWIZRR-UHFFFAOYSA-N
Compound name
1-(1H-imidazo[4,5-b]pyridin-2-yloxy)-3-morpholin-4-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.13788 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.14516 161.8
[M+Na]+ 301.12710 167.5
[M-H]- 277.13060 161.4
[M+NH4]+ 296.17170 171.7
[M+K]+ 317.10104 164.5
[M+H-H2O]+ 261.13514 151.7
[M+HCOO]- 323.13608 174.4
[M+CH3COO]- 337.15173 170.6
[M+Na-2H]- 299.11255 166.2
[M]+ 278.13733 160.1
[M]- 278.13843 160.1
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.