CID 16640

2210-79-9

Structural Information

Molecular Formula

C₁₀H₁₂O₂

SMILES

CC1=CC=CC=C1OCC2CO2

InChI

InChI=1S/C10H12O2/c1-8-4-2-3-5-10(8)12-7-9-6-11-9/h2-5,9H,6-7H2,1H3

InChIKey

KFUSXMDYOPXKKT-UHFFFAOYSA-N

Compound name

2-[(2-methylphenoxy)methyl]oxirane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 5032
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	135.2
[M+Na]+	187.07294	150.3
[M+NH4]+	182.11754	145.0
[M+K]+	203.04688	145.1
[M-H]-	163.07644	147.1
[M+Na-2H]-	185.05839	145.7
[M]+	164.08317	142.0
[M]-	164.08427	142.0

Literature stripe

literature stripe

Patent stripe

patents stripe