CID 111636

4-amino-6-ethoxy-o-cresol hydrochloride

Structural Information

Molecular Formula

C₉H₁₃NO₂

SMILES

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

InChI

InChI=1S/C9H13NO2/c1-3-12-8-5-7(10)4-6(2)9(8)11/h4-5,11H,3,10H2,1-2H3

InChIKey

JANNGSPAQYJDAH-UHFFFAOYSA-N

Compound name

4-amino-2-ethoxy-6-methylphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 167.09464 Da
Monoisotopic Mass: 1.6
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]+	168.10192	134.4
[M+Na]+	190.08386	146.4
[M+NH4]+	185.12846	142.4
[M+K]+	206.05780	140.9
[M-H]-	166.08736	136.5
[M+Na-2H]-	188.06931	140.2
[M]+	167.09409	136.5
[M]-	167.09519	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe