CID 14926076

154928-15-1

Structural Information

Molecular Formula

C₁₁H₁₀N₂O

SMILES

CN1C(=O)C=CC=C1C2=CC=CC=N2

InChI

InChI=1S/C11H10N2O/c1-13-10(6-4-7-11(13)14)9-5-2-3-8-12-9/h2-8H,1H3

InChIKey

IXPQFGHJFIWQLE-UHFFFAOYSA-N

Compound name

1-methyl-6-pyridin-2-ylpyridin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 186.07932 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	187.086596	137.6
[M+Na]+	209.068538	147.8
[M-H]-	185.072044	142.2
[M+NH4]+	204.113143	154.8
[M+K]+	225.042478	144.0
[M+H-H2O]+	169.076580	129.3
[M+HCOO]-	231.077521	160.7
[M+CH3COO]-	245.093171	151.3
[M+Na-2H]-	207.053986	146.0
[M]+	186.07877142	138.1
[M]-	186.07986858	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe