CID 44145060

71520-01-9

Structural Information

Molecular Formula
C20H24N2O8
SMILES
CC(=C)C(=O)OCCOC(=O)NC1=CC=CC=C1NC(=O)OCCOC(=O)C(=C)C
InChI
InChI=1S/C20H24N2O8/c1-13(2)17(23)27-9-11-29-19(25)21-15-7-5-6-8-16(15)22-20(26)30-12-10-28-18(24)14(3)4/h5-8H,1,3,9-12H2,2,4H3,(H,21,25)(H,22,26)
InChIKey
MHCXRJHMCKOMFE-UHFFFAOYSA-N
Compound name
2-[[2-[2-(2-methylprop-2-enoyloxy)ethoxycarbonylamino]phenyl]carbamoyloxy]ethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.15326 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.16054 196.9
[M+Na]+ 443.14248 198.3
[M-H]- 419.14598 199.2
[M+NH4]+ 438.18708 205.5
[M+K]+ 459.11642 198.8
[M+H-H2O]+ 403.15052 188.2
[M+HCOO]- 465.15146 216.8
[M+CH3COO]- 479.16711 229.0
[M+Na-2H]- 441.12793 193.1
[M]+ 420.15271 202.6
[M]- 420.15381 202.6
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.