CID 48552

66941-75-1

Structural Information

Molecular Formula
C11H14N2O3
SMILES
CC(C=C)C1(C(=O)NC(=O)NC1=O)CC=C
InChI
InChI=1S/C11H14N2O3/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15/h4-5,7H,1-2,6H2,3H3,(H2,12,13,14,15,16)
InChIKey
JXXNCMHCJAQCAP-UHFFFAOYSA-N
Compound name
5-but-3-en-2-yl-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

222.10045 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.10773 152.2
[M+Na]+ 245.08967 161.1
[M+NH4]+ 240.13427 157.7
[M+K]+ 261.06361 155.1
[M-H]- 221.09317 149.3
[M+Na-2H]- 243.07512 154.2
[M]+ 222.09990 152.2
[M]- 222.10100 152.2
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.