CID 10397916

Hydroxy methylphenylpyridinone

Structural Information

Molecular Formula
C12H11NO2
SMILES
CC1=C(C(=O)C=CN1C2=CC=CC=C2)O
InChI
InChI=1S/C12H11NO2/c1-9-12(15)11(14)7-8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3
InChIKey
BNXSABDYGOUQQI-UHFFFAOYSA-N
Compound name
3-hydroxy-2-methyl-1-phenylpyridin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

6
Patents

201.07898 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.08626 140.8
[M+Na]+ 224.06820 150.9
[M-H]- 200.07170 145.8
[M+NH4]+ 219.11280 158.3
[M+K]+ 240.04214 147.0
[M+H-H2O]+ 184.07624 133.6
[M+HCOO]- 246.07718 163.7
[M+CH3COO]- 260.09283 182.8
[M+Na-2H]- 222.05365 147.4
[M]+ 201.07843 141.2
[M]- 201.07953 141.2
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