CID 7827

2-ethoxyethyl acrylate

Structural Information

Molecular Formula

C₇H₁₂O₃

SMILES

CCOCCOC(=O)C=C

InChI

InChI=1S/C7H12O3/c1-3-7(8)10-6-5-9-4-2/h3H,1,4-6H2,2H3

InChIKey

FWWXYLGCHHIKNY-UHFFFAOYSA-N

Compound name

2-ethoxyethyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 0
References: 26170
Patents: 144.07864 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]+	145.08592	129.6
[M+Na]+	167.06786	136.8
[M-H]-	143.07136	129.8
[M+NH4]+	162.11246	151.2
[M+K]+	183.04180	137.0
[M+H-H2O]+	127.07590	124.9
[M+HCOO]-	189.07684	153.2
[M+CH3COO]-	203.09249	174.5
[M+Na-2H]-	165.05331	135.0
[M]+	144.07809	133.5
[M]-	144.07919	133.5

Literature stripe

literature stripe

Patent stripe

patents stripe