CID 78088

4383-05-5

Structural Information

Molecular Formula

C₈H₁₀O₃

SMILES

COC1=CC=CC(=C1O)CO

InChI

InChI=1S/C8H10O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-4,9-10H,5H2,1H3

InChIKey

OSZHSESNQIMXMZ-UHFFFAOYSA-N

Compound name

2-(hydroxymethyl)-6-methoxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 151
Patents: 154.06299 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]+	155.07027	128.9
[M+Na]+	177.05221	137.7
[M-H]-	153.05571	130.6
[M+NH4]+	172.09681	149.1
[M+K]+	193.02615	135.8
[M+H-H2O]+	137.06025	124.0
[M+HCOO]-	199.06119	151.5
[M+CH3COO]-	213.07684	171.4
[M+Na-2H]-	175.03766	135.3
[M]+	154.06244	129.8
[M]-	154.06354	129.8

Literature stripe

literature stripe

Patent stripe

patents stripe