CID 3051852

Brn 1458488

Structural Information

Molecular Formula
C14H15NO2
SMILES
CCOC1=CC(=CC(=O)N1C)C2=CC=CC=C2
InChI
InChI=1S/C14H15NO2/c1-3-17-14-10-12(9-13(16)15(14)2)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3
InChIKey
UHFVJXVIJCJFOT-UHFFFAOYSA-N
Compound name
6-ethoxy-1-methyl-4-phenylpyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.11028 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.11756 149.4
[M+Na]+ 252.09950 159.1
[M-H]- 228.10300 155.5
[M+NH4]+ 247.14410 166.5
[M+K]+ 268.07344 155.6
[M+H-H2O]+ 212.10754 141.5
[M+HCOO]- 274.10848 173.1
[M+CH3COO]- 288.12413 191.4
[M+Na-2H]- 250.08495 155.4
[M]+ 229.10973 152.3
[M]- 229.11083 152.3
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

No patent data available for this compound.