CID 17049

Butyl glycidyl ether

Structural Information

Molecular Formula

C₇H₁₄O₂

SMILES

CCCCOCC1CO1

InChI

InChI=1S/C7H14O2/c1-2-3-4-8-5-7-6-9-7/h7H,2-6H2,1H3

InChIKey

YSUQLAYJZDEMOT-UHFFFAOYSA-N

Compound name

2-(butoxymethyl)oxirane

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 19
References: 47884
Patents: 130.09938 Da
Monoisotopic Mass: 1.0
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]+	131.10666	128.5
[M+Na]+	153.08860	137.4
[M-H]-	129.09210	133.8
[M+NH4]+	148.13320	144.7
[M+K]+	169.06254	137.7
[M+H-H2O]+	113.09664	122.4
[M+HCOO]-	175.09758	151.8
[M+CH3COO]-	189.11323	176.2
[M+Na-2H]-	151.07405	136.7
[M]+	130.09883	134.8
[M]-	130.09993	134.8

Literature stripe

literature stripe

Patent stripe

patents stripe