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]+ 314.19621 177.7
[M+Na]+ 336.17815 180.4
[M-H]- 312.18165 178.0
[M+NH4]+ 331.22275 192.3
[M+K]+ 352.15209 181.0
[M+H-H2O]+ 296.18619 170.8
[M+HCOO]- 358.18713 197.8
[M+CH3COO]- 372.20278 214.0
[M+Na-2H]- 334.16360 174.4
[M]+ 313.18838 185.0
[M]- 313.18948 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.