CID 155822589

2-{spiro[2.5]octan-4-yl}ethan-1-ol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

C1CCC2(CC2)C(C1)CCO

InChI

InChI=1S/C10H18O/c11-8-4-9-3-1-2-5-10(9)6-7-10/h9,11H,1-8H2

InChIKey

DKGAUYUKKWOXNR-UHFFFAOYSA-N

Compound name

2-spiro[2.5]octan-8-ylethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 154.13577 Da
Monoisotopic Mass: 3.1
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]+	155.14305	135.9
[M+Na]+	177.12499	142.9
[M-H]-	153.12849	140.7
[M+NH4]+	172.16959	153.6
[M+K]+	193.09893	141.0
[M+H-H2O]+	137.13303	130.8
[M+HCOO]-	199.13397	154.6
[M+CH3COO]-	213.14962	176.9
[M+Na-2H]-	175.11044	142.2
[M]+	154.13522	133.9
[M]-	154.13632	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.