CID 87889

6-phenyl-2-pyridone

Structural Information

Molecular Formula
C11H9NO
SMILES
C1=CC=C(C=C1)C2=CC=CC(=O)N2
InChI
InChI=1S/C11H9NO/c13-11-8-4-7-10(12-11)9-5-2-1-3-6-9/h1-8H,(H,12,13)
InChIKey
ZLUIDXRFWSPPCC-UHFFFAOYSA-N
Compound name
6-phenyl-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

98
Patents

171.06842 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.07570 133.2
[M+Na]+ 194.05764 142.0
[M-H]- 170.06114 137.6
[M+NH4]+ 189.10224 151.4
[M+K]+ 210.03158 137.6
[M+H-H2O]+ 154.06568 126.1
[M+HCOO]- 216.06662 156.3
[M+CH3COO]- 230.08227 146.8
[M+Na-2H]- 192.04309 141.9
[M]+ 171.06787 131.0
[M]- 171.06897 131.0
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