CID 146296

(+)-benzyl glycidyl ether

Structural Information

Molecular Formula

C₁₀H₁₂O₂

SMILES

C1[C@H](O1)COCC2=CC=CC=C2

InChI

InChI=1S/C10H12O2/c1-2-4-9(5-3-1)6-11-7-10-8-12-10/h1-5,10H,6-8H2/t10-/m1/s1

InChIKey

QNYBOILAKBSWFG-SNVBAGLBSA-N

Compound name

(2S)-2-(phenylmethoxymethyl)oxirane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1785
Patents: 164.08372 Da
Monoisotopic Mass: 1.3
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	132.7
[M+Na]+	187.07294	141.7
[M-H]-	163.07644	140.9
[M+NH4]+	182.11754	147.3
[M+K]+	203.04688	141.2
[M+H-H2O]+	147.08098	125.8
[M+HCOO]-	209.08192	156.9
[M+CH3COO]-	223.09757	180.4
[M+Na-2H]-	185.05839	141.9
[M]+	164.08317	137.5
[M]-	164.08427	137.5

Literature stripe

literature stripe

Patent stripe

patents stripe