CID 137935848

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

Structural Information

Molecular Formula

C₇H₁₄O₂

SMILES

CC1CCOC1CCO

InChI

InChI=1S/C7H14O2/c1-6-3-5-9-7(6)2-4-8/h6-8H,2-5H2,1H3

InChIKey

JHDSJZQUTVBWSR-UHFFFAOYSA-N

Compound name

2-(3-methyloxolan-2-yl)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 130.09938 Da
Monoisotopic Mass: 0.7
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]+	131.106656	127.4
[M+Na]+	153.088598	134.0
[M-H]-	129.092104	130.0
[M+NH4]+	148.133203	149.4
[M+K]+	169.062538	134.2
[M+H-H2O]+	113.096640	123.0
[M+HCOO]-	175.097581	148.4
[M+CH3COO]-	189.113231	168.5
[M+Na-2H]-	151.074046	132.3
[M]+	130.09883142	126.4
[M]-	130.09992858	126.4

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.