CID 3065309

4h-1,3,4-oxadiazin-5(6h)-one, 2-(2,6-dimethylimidazo(1,2-a)pyridin-3-yl)-

Structural Information

Molecular Formula
C12H12N4O2
SMILES
CC1=CN2C(=NC(=C2C3=NNC(=O)CO3)C)C=C1
InChI
InChI=1S/C12H12N4O2/c1-7-3-4-9-13-8(2)11(16(9)5-7)12-15-14-10(17)6-18-12/h3-5H,6H2,1-2H3,(H,14,17)
InChIKey
AYRJDLNLBATKMA-UHFFFAOYSA-N
Compound name
2-(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)-4H-1,3,4-oxadiazin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

244.09602 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.10330 154.4
[M+Na]+ 267.08524 169.4
[M+NH4]+ 262.12984 161.1
[M+K]+ 283.05918 165.5
[M-H]- 243.08874 157.1
[M+Na-2H]- 265.07069 160.2
[M]+ 244.09547 157.2
[M]- 244.09657 157.2
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