CID 121565

1952-37-0

Structural Information

Molecular Formula

C₉H₁₁NO₂

SMILES

C1=CC(=CC=C1C=NCCO)O

InChI

InChI=1S/C9H11NO2/c11-6-5-10-7-8-1-3-9(12)4-2-8/h1-4,7,11-12H,5-6H2

InChIKey

YBIMGWHAVLSEEF-UHFFFAOYSA-N

Compound name

4-(2-hydroxyethyliminomethyl)phenol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 26
Patents: 165.07898 Da
Monoisotopic Mass: 0.5
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]+	166.08626	134.3
[M+Na]+	188.06820	146.0
[M+NH4]+	183.11280	142.3
[M+K]+	204.04214	139.7
[M-H]-	164.07170	136.2
[M+Na-2H]-	186.05365	140.9
[M]+	165.07843	136.3
[M]-	165.07953	136.3

Literature stripe

literature stripe

Patent stripe

patents stripe