CID 4532059

2-allyloxytetrahydropyran

Structural Information

Molecular Formula

C₈H₁₄O₂

SMILES

C=CCOC1CCCCO1

InChI

InChI=1S/C8H14O2/c1-2-6-9-8-5-3-4-7-10-8/h2,8H,1,3-7H2

InChIKey

NRAKYXXDEXCVMV-UHFFFAOYSA-N

Compound name

2-prop-2-enoxyoxane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 130
Patents: 142.09938 Da
Monoisotopic Mass: 1.6
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]+	143.10666	129.8
[M+Na]+	165.08860	134.8
[M-H]-	141.09210	133.1
[M+NH4]+	160.13320	149.8
[M+K]+	181.06254	135.3
[M+H-H2O]+	125.09664	124.3
[M+HCOO]-	187.09758	150.1
[M+CH3COO]-	201.11323	172.5
[M+Na-2H]-	163.07405	136.7
[M]+	142.09883	127.9
[M]-	142.09993	127.9

Literature stripe

literature stripe

Patent stripe

patents stripe