CID 7041

2,6-dimethoxyphenol

Structural Information

Molecular Formula

C₈H₁₀O₃

SMILES

COC1=C(C(=CC=C1)OC)O

InChI

InChI=1S/C8H10O3/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5,9H,1-2H3

InChIKey

KLIDCXVFHGNTTM-UHFFFAOYSA-N

Compound name

2,6-dimethoxyphenol

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 219
References: 14085
Patents: 154.06299 Da
Monoisotopic Mass: 1.1
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	128.8
[M+Na]+	177.05221	141.8
[M+NH4]+	172.09681	137.2
[M+K]+	193.02615	136.3
[M-H]-	153.05571	130.3
[M+Na-2H]-	175.03766	135.5
[M]+	154.06244	131.0
[M]-	154.06354	131.0

Literature stripe

literature stripe

Patent stripe

patents stripe