CID 97344

2-amino-5-ethoxyphenol

Structural Information

Molecular Formula

C₈H₁₁NO₂

SMILES

CCOC1=CC(=C(C=C1)N)O

InChI

InChI=1S/C8H11NO2/c1-2-11-6-3-4-7(9)8(10)5-6/h3-5,10H,2,9H2,1H3

InChIKey

KJTXCKZBFHBRQT-UHFFFAOYSA-N

Compound name

2-amino-5-ethoxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 779
Patents: 153.07898 Da
Monoisotopic Mass: 1.2
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]+	154.086256	130.1
[M+Na]+	176.068198	138.5
[M-H]-	152.071704	132.5
[M+NH4]+	171.112803	150.5
[M+K]+	192.042138	136.5
[M+H-H2O]+	136.076240	124.7
[M+HCOO]-	198.077181	154.3
[M+CH3COO]-	212.092831	176.2
[M+Na-2H]-	174.053646	136.1
[M]+	153.07843142	129.6
[M]-	153.07952858	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe