CID 59913131

(3-allyl-3-oxolanyl)methanol

Structural Information

Molecular Formula

C₈H₁₄O₂

SMILES

C=CCC1(CCOC1)CO

InChI

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

InChIKey

OJRRTKVBVNRHRJ-UHFFFAOYSA-N

Compound name

(3-prop-2-enyloxolan-3-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 142.09938 Da
Monoisotopic Mass: 0.7
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	130.3
[M+Na]+	165.08860	136.7
[M-H]-	141.09210	132.7
[M+NH4]+	160.13320	153.4
[M+K]+	181.06254	136.3
[M+H-H2O]+	125.09664	126.4
[M+HCOO]-	187.09758	151.2
[M+CH3COO]-	201.11323	169.1
[M+Na-2H]-	163.07405	136.5
[M]+	142.09883	128.8
[M]-	142.09993	128.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe