CID 59594973

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

Structural Information

Molecular Formula

C₆H₁₂O₂

SMILES

CC(C1CCOC1)O

InChI

InChI=1S/C6H12O2/c1-5(7)6-2-3-8-4-6/h5-7H,2-4H2,1H3

InChIKey

ARDSHQRPKXPELC-UHFFFAOYSA-N

Compound name

1-(oxolan-3-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 22
Patents: 116.08373 Da
Monoisotopic Mass: 0.2
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]+	117.09101	123.5
[M+Na]+	139.07295	132.7
[M+NH4]+	134.11755	132.0
[M+K]+	155.04689	130.4
[M-H]-	115.07645	125.2
[M+Na-2H]-	137.05840	126.9
[M]+	116.08318	125.0
[M]-	116.08428	125.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe