CID 55805

Alpha-((dimethylamino)methyl)-3-hydroxybenzyl alcohol hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₅NO₂

SMILES

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

InChI

InChI=1S/C10H15NO2/c1-11(2)7-10(13)8-4-3-5-9(12)6-8/h3-6,10,12-13H,7H2,1-2H3

InChIKey

AJDGKKHSAASQEK-UHFFFAOYSA-N

Compound name

3-[2-(dimethylamino)-1-hydroxyethyl]phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 181.11028 Da
Monoisotopic Mass: 0.2
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]+	182.11756	139.9
[M+Na]+	204.09950	150.6
[M+NH4]+	199.14410	147.7
[M+K]+	220.07344	145.8
[M-H]-	180.10300	141.6
[M+Na-2H]-	202.08495	145.6
[M]+	181.10973	141.7
[M]-	181.11083	141.7

Literature stripe

literature stripe

Patent stripe

patents stripe