CID 257087

1-ethyl-1,3-diazinane-2,4,6-trione

Structural Information

Molecular Formula
C6H8N2O3
SMILES
CCN1C(=O)CC(=O)NC1=O
InChI
InChI=1S/C6H8N2O3/c1-2-8-5(10)3-4(9)7-6(8)11/h2-3H2,1H3,(H,7,9,11)
InChIKey
SGKUPLCQYHQBTN-UHFFFAOYSA-N
Compound name
1-ethyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

175
Patents

156.0535 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.06078 132.1
[M+Na]+ 179.04272 142.7
[M+NH4]+ 174.08732 138.0
[M+K]+ 195.01666 138.6
[M-H]- 155.04622 130.6
[M+Na-2H]- 177.02817 134.9
[M]+ 156.05295 132.7
[M]- 156.05405 132.7
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