CID 12120398

2,2'-(4-methoxypyridine-2,6-diyl)bis(4,5-dihydrooxazole)

Structural Information

Molecular Formula
C12H13N3O3
SMILES
COC1=CC(=NC(=C1)C2=NCCO2)C3=NCCO3
InChI
InChI=1S/C12H13N3O3/c1-16-8-6-9(11-13-2-4-17-11)15-10(7-8)12-14-3-5-18-12/h6-7H,2-5H2,1H3
InChIKey
XXLPHNXUUWGBOQ-UHFFFAOYSA-N
Compound name
2-[6-(4,5-dihydro-1,3-oxazol-2-yl)-4-methoxypyridin-2-yl]-4,5-dihydro-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.09569 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.10297 152.6
[M+Na]+ 270.08491 165.5
[M+NH4]+ 265.12951 159.6
[M+K]+ 286.05885 164.5
[M-H]- 246.08841 158.1
[M+Na-2H]- 268.07036 159.2
[M]+ 247.09514 155.9
[M]- 247.09624 155.9
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.