CID 66936595

6-methyl-1h,2h,3h-pyrido[2,3-b][1,4]oxazin-2-one

Structural Information

Molecular Formula
C8H8N2O2
SMILES
CC1=NC2=C(C=C1)NC(=O)CO2
InChI
InChI=1S/C8H8N2O2/c1-5-2-3-6-8(9-5)12-4-7(11)10-6/h2-3H,4H2,1H3,(H,10,11)
InChIKey
OBKUXCCMPCVLGB-UHFFFAOYSA-N
Compound name
6-methyl-1H-pyrido[2,3-b][1,4]oxazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

164.05858 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.065856 131.9
[M+Na]+ 187.047798 141.0
[M-H]- 163.051304 133.1
[M+NH4]+ 182.092403 149.1
[M+K]+ 203.021738 139.1
[M+H-H2O]+ 147.055840 124.9
[M+HCOO]- 209.056781 149.4
[M+CH3COO]- 223.072431 144.8
[M+Na-2H]- 185.033246 140.7
[M]+ 164.05803142 130.1
[M]- 164.05912858 130.1
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

patents stripe