CID 11252531

73096-98-7

Structural Information

Molecular Formula

C₁₁H₁₅NO₂

SMILES

CC(=O)C1=CC(=C(C=C1)O)CN(C)C

InChI

InChI=1S/C11H15NO2/c1-8(13)9-4-5-11(14)10(6-9)7-12(2)3/h4-6,14H,7H2,1-3H3

InChIKey

WAENDPRPZPEBQR-UHFFFAOYSA-N

Compound name

1-[3-[(dimethylamino)methyl]-4-hydroxyphenyl]ethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 193.11028 Da
Monoisotopic Mass: 1.1
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]+	194.11756	142.8
[M+Na]+	216.09950	154.3
[M+NH4]+	211.14410	150.5
[M+K]+	232.07344	149.1
[M-H]-	192.10300	144.8
[M+Na-2H]-	214.08495	148.5
[M]+	193.10973	144.8
[M]-	193.11083	144.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.