CID 281888

Glycidyl propargyl ether

Structural Information

Molecular Formula

C₆H₈O₂

SMILES

C#CCOCC1CO1

InChI

InChI=1S/C6H8O2/c1-2-3-7-4-6-5-8-6/h1,6H,3-5H2

InChIKey

SYFZCLMMUNCHNH-UHFFFAOYSA-N

Compound name

2-(prop-2-ynoxymethyl)oxirane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1027
Patents: 112.05243 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]+	113.059706	114.3
[M+Na]+	135.041648	130.1
[M-H]-	111.045154	120.3
[M+NH4]+	130.086253	131.1
[M+K]+	151.015588	126.7
[M+H-H2O]+	95.049690	105.4
[M+HCOO]-	157.050631	134.4
[M+CH3COO]-	171.066281	180.8
[M+Na-2H]-	133.027096	124.4
[M]+	112.05188142	116.0
[M]-	112.05297858	116.0

Literature stripe

literature stripe

Patent stripe

patents stripe