CID 3016467

48067-72-7

Structural Information

Molecular Formula

C₁₀H₁₈O₅

SMILES

COCCOCCOCCOC(=O)C=C

InChI

InChI=1S/C10H18O5/c1-3-10(11)15-9-8-14-7-6-13-5-4-12-2/h3H,1,4-9H2,2H3

InChIKey

NMLCFUMBGQIRJX-UHFFFAOYSA-N

Compound name

2-[2-(2-methoxyethoxy)ethoxy]ethyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1912
Patents: 218.11542 Da
Monoisotopic Mass: 0.3
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]+	219.12270	149.4
[M+Na]+	241.10464	157.5
[M+NH4]+	236.14924	154.5
[M+K]+	257.07858	152.9
[M-H]-	217.10814	146.5
[M+Na-2H]-	239.09009	150.5
[M]+	218.11487	149.2
[M]-	218.11597	149.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe