CID 26632

14321-29-0

Structural Information

Molecular Formula
C10H15N3O3
SMILES
CC(CC1(C(=O)NC(=O)NC1=O)CC=C)N
InChI
InChI=1S/C10H15N3O3/c1-3-4-10(5-6(2)11)7(14)12-9(16)13-8(10)15/h3,6H,1,4-5,11H2,2H3,(H2,12,13,14,15,16)
InChIKey
FJHYSMADJBFFPL-UHFFFAOYSA-N
Compound name
5-(2-aminopropyl)-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

225.11134 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.11862 150.7
[M+Na]+ 248.10056 157.4
[M-H]- 224.10406 148.2
[M+NH4]+ 243.14516 166.3
[M+K]+ 264.07450 153.6
[M+H-H2O]+ 208.10860 145.0
[M+HCOO]- 270.10954 165.7
[M+CH3COO]- 284.12519 187.2
[M+Na-2H]- 246.08601 151.9
[M]+ 225.11079 144.7
[M]- 225.11189 144.7
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

No patent data available for this compound.