CID 75678

O-(isopropoxy)anisole

Structural Information

Molecular Formula

C₁₀H₁₄O₂

SMILES

CC(C)OC1=CC=CC=C1OC

InChI

InChI=1S/C10H14O2/c1-8(2)12-10-7-5-4-6-9(10)11-3/h4-8H,1-3H3

InChIKey

HZXKDBNTDXFOIG-UHFFFAOYSA-N

Compound name

1-methoxy-2-propan-2-yloxybenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 121
Patents: 166.09938 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]+	167.10666	134.7
[M+Na]+	189.08860	147.7
[M+NH4]+	184.13320	143.6
[M+K]+	205.06254	141.4
[M-H]-	165.09210	137.0
[M+Na-2H]-	187.07405	141.9
[M]+	166.09883	137.2
[M]-	166.09993	137.2

Literature stripe

literature stripe

Patent stripe

patents stripe