CID 44153361

93962-71-1

Structural Information

Molecular Formula
C16H27NO5
SMILES
CC(=C)C(=O)OCCN(CCCOC)CCOC(=O)C(=C)C
InChI
InChI=1S/C16H27NO5/c1-13(2)15(18)21-11-8-17(7-6-10-20-5)9-12-22-16(19)14(3)4/h1,3,6-12H2,2,4-5H3
InChIKey
ZVIKFWVRCHOWFC-UHFFFAOYSA-N
Compound name
2-[3-methoxypropyl-[2-(2-methylprop-2-enoyloxy)ethyl]amino]ethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.18893 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.196206 177.7
[M+Na]+ 336.178148 180.4
[M-H]- 312.181654 178.0
[M+NH4]+ 331.222753 192.3
[M+K]+ 352.152088 181.0
[M+H-H2O]+ 296.186190 170.8
[M+HCOO]- 358.187131 197.8
[M+CH3COO]- 372.202781 214.0
[M+Na-2H]- 334.163596 174.4
[M]+ 313.18838142 185.0
[M]- 313.18947858 185.0
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

No patent data available for this compound.