CID 11492

M-tyramine

Structural Information

Molecular Formula

SMILES

C1=CC(=CC(=C1)O)CCN

InChI

InChI=1S/C8H11NO/c9-5-4-7-2-1-3-8(10)6-7/h1-3,6,10H,4-5,9H2

InChIKey

GHFGJTVYMNRGBY-UHFFFAOYSA-N

Compound name

3-(2-aminoethyl)phenol

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 51
References: 1082
Patents: 137.08406 Da
Monoisotopic Mass: 0.9
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]+	138.09134	127.1
[M+Na]+	160.07328	139.1
[M+NH4]+	155.11788	136.0
[M+K]+	176.04722	132.9
[M-H]-	136.07678	129.7
[M+Na-2H]-	158.05873	134.2
[M]+	137.08351	129.4
[M]-	137.08461	129.4

Literature stripe

literature stripe

Patent stripe

patents stripe