CID 11126225

2-(oxolan-3-yl)ethan-1-ol

Structural Information

Molecular Formula

C₆H₁₂O₂

SMILES

C1COCC1CCO

InChI

InChI=1S/C6H12O2/c7-3-1-6-2-4-8-5-6/h6-7H,1-5H2

InChIKey

SVNHEBUGYPWWOF-UHFFFAOYSA-N

Compound name

2-(oxolan-3-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 217
Patents: 116.08373 Da
Monoisotopic Mass: 0.1
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]+	117.091006	123.3
[M+Na]+	139.072948	129.3
[M-H]-	115.076454	125.6
[M+NH4]+	134.117553	145.5
[M+K]+	155.046888	129.8
[M+H-H2O]+	99.080990	118.7
[M+HCOO]-	161.081931	144.6
[M+CH3COO]-	175.097581	164.4
[M+Na-2H]-	137.058396	129.3
[M]+	116.08318142	121.4
[M]-	116.08427858	121.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe