CID 12354337

3-ethylpyridin-2-ol

Structural Information

Molecular Formula
C7H9NO
SMILES
CCC1=CC=CNC1=O
InChI
InChI=1S/C7H9NO/c1-2-6-4-3-5-8-7(6)9/h3-5H,2H2,1H3,(H,8,9)
InChIKey
KWFQLEGOEWMCCK-UHFFFAOYSA-N
Compound name
3-ethyl-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

123.06841 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.07569 122.6
[M+Na]+ 146.05763 136.2
[M+NH4]+ 141.10223 131.2
[M+K]+ 162.03157 129.7
[M-H]- 122.06113 124.0
[M+Na-2H]- 144.04308 130.1
[M]+ 123.06786 124.9
[M]- 123.06896 124.9
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