CID 15534895

3-ethylpyridin-4-ol

Structural Information

Molecular Formula
C7H9NO
SMILES
CCC1=CNC=CC1=O
InChI
InChI=1S/C7H9NO/c1-2-6-5-8-4-3-7(6)9/h3-5H,2H2,1H3,(H,8,9)
InChIKey
GUJWNUGFAGOVFH-UHFFFAOYSA-N
Compound name
3-ethyl-1H-pyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

123.06841 Da
Monoisotopic Mass

0.9
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

No literature data available for this compound.

Patent stripe

patents stripe