CID 23321219

4-cyclobutoxyphenol

Structural Information

Molecular Formula

C₁₀H₁₂O₂

SMILES

C1CC(C1)OC2=CC=C(C=C2)O

InChI

InChI=1S/C10H12O2/c11-8-4-6-10(7-5-8)12-9-2-1-3-9/h4-7,9,11H,1-3H2

InChIKey

JMPKALGPOJXWQP-UHFFFAOYSA-N

Compound name

4-cyclobutyloxyphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 164.08372 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]+	165.09100	128.6
[M+Na]+	187.07294	134.6
[M-H]-	163.07644	134.0
[M+NH4]+	182.11754	142.2
[M+K]+	203.04688	135.7
[M+H-H2O]+	147.08098	117.8
[M+HCOO]-	209.08192	150.2
[M+CH3COO]-	223.09757	178.6
[M+Na-2H]-	185.05839	135.2
[M]+	164.08317	136.1
[M]-	164.08427	136.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe