CID 17111

2-(dimethylamino)ethyl acrylate

Structural Information

Molecular Formula
C7H13NO2
SMILES
CN(C)CCOC(=O)C=C
InChI
InChI=1S/C7H13NO2/c1-4-7(9)10-6-5-8(2)3/h4H,1,5-6H2,2-3H3
InChIKey
DPBJAVGHACCNRL-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

9
References

68449
Patents

143.09464 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 130.8
[M+Na]+ 166.08386 137.4
[M-H]- 142.08736 132.6
[M+NH4]+ 161.12846 152.8
[M+K]+ 182.05780 138.5
[M+H-H2O]+ 126.09190 125.7
[M+HCOO]- 188.09284 155.8
[M+CH3COO]- 202.10849 180.8
[M+Na-2H]- 164.06931 135.7
[M]+ 143.09409 133.7
[M]- 143.09519 133.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe