CID 54719915

1-cyclohexyl-4-hydroxy-6-methyl-3-phenyl-pyridin-2-one

Structural Information

Molecular Formula
C18H21NO2
SMILES
CC1=CC(=C(C(=O)N1C2CCCCC2)C3=CC=CC=C3)O
InChI
InChI=1S/C18H21NO2/c1-13-12-16(20)17(14-8-4-2-5-9-14)18(21)19(13)15-10-6-3-7-11-15/h2,4-5,8-9,12,15,20H,3,6-7,10-11H2,1H3
InChIKey
PNFAYUZGCQDWAJ-UHFFFAOYSA-N
Compound name
1-cyclohexyl-4-hydroxy-6-methyl-3-phenylpyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

283.15723 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.164506 166.8
[M+Na]+ 306.146448 173.3
[M-H]- 282.149954 173.6
[M+NH4]+ 301.191053 180.4
[M+K]+ 322.120388 168.0
[M+H-H2O]+ 266.154490 157.6
[M+HCOO]- 328.155431 184.6
[M+CH3COO]- 342.171081 177.4
[M+Na-2H]- 304.131896 168.8
[M]+ 283.15668142 162.6
[M]- 283.15777858 162.6
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

No patent data available for this compound.