CID 87693

3-(dimethylamino)propyl acrylate

Structural Information

Molecular Formula

C₈H₁₅NO₂

SMILES

CN(C)CCCOC(=O)C=C

InChI

InChI=1S/C8H15NO2/c1-4-8(10)11-7-5-6-9(2)3/h4H,1,5-7H2,2-3H3

InChIKey

UFQHFMGRRVQFNA-UHFFFAOYSA-N

Compound name

3-(dimethylamino)propyl prop-2-enoate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 11033
Patents: 157.11028 Da
Monoisotopic Mass: 1.5
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]+	158.11756	135.9
[M+Na]+	180.09950	144.8
[M+NH4]+	175.14410	142.9
[M+K]+	196.07344	140.0
[M-H]-	156.10300	135.3
[M+Na-2H]-	178.08495	138.9
[M]+	157.10973	136.6
[M]-	157.11083	136.6

Literature stripe

literature stripe

Patent stripe

patents stripe