CID 14667614

129055-62-5

Structural Information

Molecular Formula

C₉H₁₆O₂

SMILES

C1CCC2(C1)CCC(O2)CO

InChI

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

InChIKey

BZLNWPNHFDYHJX-UHFFFAOYSA-N

Compound name

1-oxaspiro[4.4]nonan-2-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	135.2
[M+Na]+	179.10426	143.4
[M+NH4]+	174.14886	145.7
[M+K]+	195.07820	140.0
[M-H]-	155.10776	138.0
[M+Na-2H]-	177.08971	139.5
[M]+	156.11449	137.0
[M]-	156.11559	137.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.