CID 134396

55302-96-0

Structural Information

Molecular Formula

C₉H₁₃NO₂

SMILES

CC1=C(C=C(C=C1)NCCO)O

InChI

InChI=1S/C9H13NO2/c1-7-2-3-8(6-9(7)12)10-4-5-11/h2-3,6,10-12H,4-5H2,1H3

InChIKey

YGRFRBUGAPOJDU-UHFFFAOYSA-N

Compound name

5-(2-hydroxyethylamino)-2-methylphenol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 9222
Patents: 167.09464 Da
Monoisotopic Mass: 1.3
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	134.9
[M+Na]+	190.08386	146.3
[M+NH4]+	185.12846	142.8
[M+K]+	206.05780	140.7
[M-H]-	166.08736	136.6
[M+Na-2H]-	188.06931	140.8
[M]+	167.09409	136.8
[M]-	167.09519	136.8

Literature stripe

literature stripe

Patent stripe

patents stripe