CID 455748

Ms-1059

Structural Information

Molecular Formula

C₁₆H₁₄N₂O

SMILES

CCC1=C(N2C=CC=CC2=N1)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O/c1-2-13-15(16(19)12-8-4-3-5-9-12)18-11-7-6-10-14(18)17-13/h3-11H,2H2,1H3

InChIKey

ORNHDKNIULQLCL-UHFFFAOYSA-N

Compound name

(2-ethylimidazo[1,2-a]pyridin-3-yl)-phenylmethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 250.11061 Da
Monoisotopic Mass: 4.3
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]+	251.117886	156.5
[M+Na]+	273.099828	166.5
[M-H]-	249.103334	162.2
[M+NH4]+	268.144433	173.8
[M+K]+	289.073768	161.3
[M+H-H2O]+	233.107870	147.8
[M+HCOO]-	295.108811	179.0
[M+CH3COO]-	309.124461	169.3
[M+Na-2H]-	271.085276	162.1
[M]+	250.11006142	159.1
[M]-	250.11115858	159.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.