CID 332

2-methoxy-4-vinylphenol

Structural Information

Molecular Formula

C₉H₁₀O₂

SMILES

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

InChI

InChI=1S/C9H10O2/c1-3-7-4-5-8(10)9(6-7)11-2/h3-6,10H,1H2,2H3

InChIKey

YOMSJEATGXXYPX-UHFFFAOYSA-N

Compound name

4-ethenyl-2-methoxyphenol

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 160
References: 4943
Patents: 150.06808 Da
Monoisotopic Mass: 2.4
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]+	151.07536	128.1
[M+Na]+	173.05730	137.3
[M-H]-	149.06080	131.2
[M+NH4]+	168.10190	149.3
[M+K]+	189.03124	135.1
[M+H-H2O]+	133.06534	123.3
[M+HCOO]-	195.06628	152.0
[M+CH3COO]-	209.08193	174.1
[M+Na-2H]-	171.04275	134.7
[M]+	150.06753	129.2
[M]-	150.06863	129.2

Literature stripe

literature stripe

Patent stripe

patents stripe