CID 84126

13972-49-1

Structural Information

Molecular Formula
C14H23NO4
SMILES
CCN(CCOC(=O)C(=C)C)CCOC(=O)C(=C)C
InChI
InChI=1S/C14H23NO4/c1-6-15(7-9-18-13(16)11(2)3)8-10-19-14(17)12(4)5/h2,4,6-10H2,1,3,5H3
InChIKey
BHICZSRCJVGOGG-UHFFFAOYSA-N
Compound name
2-[ethyl-[2-(2-methylprop-2-enoyloxy)ethyl]amino]ethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

794
Patents

269.16272 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.17000 165.9
[M+Na]+ 292.15194 169.5
[M-H]- 268.15544 166.6
[M+NH4]+ 287.19654 182.4
[M+K]+ 308.12588 170.0
[M+H-H2O]+ 252.15998 159.6
[M+HCOO]- 314.16092 186.5
[M+CH3COO]- 328.17657 206.1
[M+Na-2H]- 290.13739 163.5
[M]+ 269.16217 171.0
[M]- 269.16327 171.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe