CID 21959040

53229-74-6

Structural Information

Molecular Formula

C₁₁H₂₀O₃

SMILES

C1CCOC(C1)OC2CCCC2CO

InChI

InChI=1S/C11H20O3/c12-8-9-4-3-5-10(9)14-11-6-1-2-7-13-11/h9-12H,1-8H2

InChIKey

VGPZOQUMOOQFOH-UHFFFAOYSA-N

Compound name

[2-(oxan-2-yloxy)cyclopentyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 200.14125 Da
Monoisotopic Mass: 1.4
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]+	201.14853	146.1
[M+Na]+	223.13047	149.2
[M-H]-	199.13397	150.6
[M+NH4]+	218.17507	164.5
[M+K]+	239.10441	148.8
[M+H-H2O]+	183.13851	140.2
[M+HCOO]-	245.13945	163.2
[M+CH3COO]-	259.15510	179.4
[M+Na-2H]-	221.11592	148.1
[M]+	200.14070	141.2
[M]-	200.14180	141.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe