CID 5383414

[(e)-2-ethoxyethenyl]benzene

Structural Information

Molecular Formula

C₁₀H₁₂O

SMILES

CCO/C=C/C1=CC=CC=C1

InChI

InChI=1S/C10H12O/c1-2-11-9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+

InChIKey

FZHNODDFDJBMAS-CMDGGOBGSA-N

Compound name

[(E)-2-ethoxyethenyl]benzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 148.08882 Da
Monoisotopic Mass: 2.7
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]+	149.09610	131.4
[M+Na]+	171.07804	144.9
[M+NH4]+	166.12264	140.7
[M+K]+	187.05198	136.9
[M-H]-	147.08154	134.2
[M+Na-2H]-	169.06349	139.5
[M]+	148.08827	134.1
[M]-	148.08937	134.1

Literature stripe

literature stripe

Patent stripe

patents stripe