CID 170752

45103-58-0

Structural Information

Molecular Formula

C₉H₁₆O₄

SMILES

CC(=C)C(=O)OCCOCCOC

InChI

InChI=1S/C9H16O4/c1-8(2)9(10)13-7-6-12-5-4-11-3/h1,4-7H2,2-3H3

InChIKey

DAVVKEZTUOGEAK-UHFFFAOYSA-N

Compound name

2-(2-methoxyethoxy)ethyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 27
References: 8536
Patents: 188.10486 Da
Monoisotopic Mass: 0.9
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]+	189.11214	142.2
[M+Na]+	211.09408	150.7
[M+NH4]+	206.13868	148.0
[M+K]+	227.06802	146.6
[M-H]-	187.09758	139.7
[M+Na-2H]-	209.07953	143.8
[M]+	188.10431	142.3
[M]-	188.10541	142.3

Literature stripe

literature stripe

Patent stripe

patents stripe