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]+ 239.10263 151.0
[M+Na]+ 261.08457 158.3
[M-H]- 237.08807 148.9
[M+NH4]+ 256.12917 166.6
[M+K]+ 277.05851 154.6
[M+H-H2O]+ 221.09261 145.4
[M+HCOO]- 283.09355 165.7
[M+CH3COO]- 297.10920 187.0
[M+Na-2H]- 259.07002 152.6
[M]+ 238.09480 147.9
[M]- 238.09590 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.