CID 25008

10143-53-0

Structural Information

Molecular Formula

C₈H₁₆O₃

SMILES

CCOCCOCCOC=C

InChI

InChI=1S/C8H16O3/c1-3-9-5-7-11-8-6-10-4-2/h3H,1,4-8H2,2H3

InChIKey

AYMDJPGTQFHDSA-UHFFFAOYSA-N

Compound name

1-(2-ethenoxyethoxy)-2-ethoxyethane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 19310
Patents: 160.10994 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]+	161.11722	135.2
[M+Na]+	183.09916	141.8
[M-H]-	159.10266	135.1
[M+NH4]+	178.14376	156.1
[M+K]+	199.07310	141.9
[M+H-H2O]+	143.10720	130.1
[M+HCOO]-	205.10814	159.3
[M+CH3COO]-	219.12379	178.3
[M+Na-2H]-	181.08461	141.3
[M]+	160.10939	141.0
[M]-	160.11049	141.0

Literature stripe

literature stripe

Patent stripe

patents stripe