CID 10666

Ricinine

Structural Information

Molecular Formula
C8H8N2O2
SMILES
CN1C=CC(=C(C1=O)C#N)OC
InChI
InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3
InChIKey
PETSAYFQSGAEQY-UHFFFAOYSA-N
Compound name
4-methoxy-1-methyl-2-oxopyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

69
References

760
Patents

164.05858 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.06586 131.8
[M+Na]+ 187.04780 144.9
[M+NH4]+ 182.09240 136.1
[M+K]+ 203.02174 136.2
[M-H]- 163.05130 125.7
[M+Na-2H]- 185.03325 135.9
[M]+ 164.05803 131.1
[M]- 164.05913 131.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe