CID 21248430

2241141-12-6

Structural Information

Molecular Formula

C₈H₁₁NO₂

SMILES

C1=CC=C(C(=C1)O)OCCN

InChI

InChI=1S/C8H11NO2/c9-5-6-11-8-4-2-1-3-7(8)10/h1-4,10H,5-6,9H2

InChIKey

XLHORNMWQFLFAF-UHFFFAOYSA-N

Compound name

2-(2-aminoethoxy)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 153.07898 Da
Monoisotopic Mass: 0.4
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]+	154.08626	130.4
[M+Na]+	176.06820	141.9
[M+NH4]+	171.11280	138.6
[M+K]+	192.04214	136.2
[M-H]-	152.07170	132.4
[M+Na-2H]-	174.05365	136.9
[M]+	153.07843	132.4
[M]-	153.07953	132.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe