CID 76533

3089-23-4

Structural Information

Molecular Formula
C11H17N3O4
SMILES
CC(=C)C(=O)OCC(=O)NCCN1CCNC1=O
InChI
InChI=1S/C11H17N3O4/c1-8(2)10(16)18-7-9(15)12-3-5-14-6-4-13-11(14)17/h1,3-7H2,2H3,(H,12,15)(H,13,17)
InChIKey
BMMZGRLRFPSWKY-UHFFFAOYSA-N
Compound name
[2-oxo-2-[2-(2-oxoimidazolidin-1-yl)ethylamino]ethyl] 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

332
Patents

255.1219 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.129176 159.0
[M+Na]+ 278.111118 163.1
[M-H]- 254.114624 157.8
[M+NH4]+ 273.155723 173.5
[M+K]+ 294.085058 161.6
[M+H-H2O]+ 238.119160 151.4
[M+HCOO]- 300.120101 176.3
[M+CH3COO]- 314.135751 193.2
[M+Na-2H]- 276.096566 157.7
[M]+ 255.12135142 157.1
[M]- 255.12244858 157.1
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