CID 48535

Brn 0239992

Structural Information

Molecular Formula
C11H14N2O4
SMILES
CCOC(=C)C1(C(=O)NC(=O)NC1=O)CC=C
InChI
InChI=1S/C11H14N2O4/c1-4-6-11(7(3)17-5-2)8(14)12-10(16)13-9(11)15/h4H,1,3,5-6H2,2H3,(H2,12,13,14,15,16)
InChIKey
QQGASJIJNLPJKJ-UHFFFAOYSA-N
Compound name
5-(1-ethoxyethenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.09535 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.102626 151.0
[M+Na]+ 261.084568 158.3
[M-H]- 237.088074 148.9
[M+NH4]+ 256.129173 166.6
[M+K]+ 277.058508 154.6
[M+H-H2O]+ 221.092610 145.4
[M+HCOO]- 283.093551 165.7
[M+CH3COO]- 297.109201 187.0
[M+Na-2H]- 259.070016 152.6
[M]+ 238.09480142 147.9
[M]- 238.09589858 147.9
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.