CID 146296

16495-13-9

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: 1779
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	136.0
[M+Na]+	187.07294	150.7
[M+NH4]+	182.11754	145.8
[M+K]+	203.04688	145.3
[M-H]-	163.07644	147.8
[M+Na-2H]-	185.05839	146.6
[M]+	164.08317	142.6
[M]-	164.08427	142.6

Literature stripe

literature stripe

Patent stripe

patents stripe