CID 74458

Allyl phenyl ether

Structural Information

Molecular Formula

C₉H₁₀O

SMILES

C=CCOC1=CC=CC=C1

InChI

InChI=1S/C9H10O/c1-2-8-10-9-6-4-3-5-7-9/h2-7H,1,8H2

InChIKey

POSICDHOUBKJKP-UHFFFAOYSA-N

Compound name

prop-2-enoxybenzene

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 11
References: 17618
Patents: 134.07317 Da
Monoisotopic Mass: 2.9
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]+	135.08045	126.7
[M+Na]+	157.06239	140.4
[M+NH4]+	152.10699	136.2
[M+K]+	173.03633	132.7
[M-H]-	133.06589	129.5
[M+Na-2H]-	155.04784	135.1
[M]+	134.07262	129.5
[M]-	134.07372	129.5

Literature stripe

literature stripe

Patent stripe

patents stripe