CID 88051

2-propenamide, n,n'-[(2-oxo-1,3-imidazolidinediyl)bis(methylene)]bis-

Structural Information

Molecular Formula
C11H16N4O3
SMILES
C=CC(=O)NCN1CCN(C1=O)CNC(=O)C=C
InChI
InChI=1S/C11H16N4O3/c1-3-9(16)12-7-14-5-6-15(11(14)18)8-13-10(17)4-2/h3-4H,1-2,5-8H2,(H,12,16)(H,13,17)
InChIKey
AMTUSIQIVCNFIN-UHFFFAOYSA-N
Compound name
N-[[2-oxo-3-[(prop-2-enoylamino)methyl]imidazolidin-1-yl]methyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

252.12224 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.129516 158.0
[M+Na]+ 275.111458 163.2
[M-H]- 251.114964 158.4
[M+NH4]+ 270.156063 173.3
[M+K]+ 291.085398 160.8
[M+H-H2O]+ 235.119500 150.0
[M+HCOO]- 297.120441 178.7
[M+CH3COO]- 311.136091 198.2
[M+Na-2H]- 273.096906 158.0
[M]+ 252.12169142 156.0
[M]- 252.12278858 156.0
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