CID 130584302

1874345-95-5

Structural Information

Molecular Formula

C₉H₁₆O₂

SMILES

C1CC(OC2(C1)CCC2)CO

InChI

InChI=1S/C9H16O2/c10-7-8-3-1-4-9(11-8)5-2-6-9/h8,10H,1-7H2

InChIKey

LQEXKIDWTNTFGC-UHFFFAOYSA-N

Compound name

5-oxaspiro[3.5]nonan-6-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 156.11504 Da
Monoisotopic Mass: 1.0
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]+	157.12232	133.2
[M+Na]+	179.10426	139.0
[M+NH4]+	174.14886	139.7
[M+K]+	195.07820	133.8
[M-H]-	155.10776	134.0
[M+Na-2H]-	177.08971	136.7
[M]+	156.11449	133.1
[M]-	156.11559	133.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.