CID 24845089

2068-43-1

Structural Information

Molecular Formula
C14H17N3O3
SMILES
CN(C)CCC1(C(=O)NC(=O)NC1=O)C2=CC=CC=C2
InChI
InChI=1S/C14H17N3O3/c1-17(2)9-8-14(10-6-4-3-5-7-10)11(18)15-13(20)16-12(14)19/h3-7H,8-9H2,1-2H3,(H2,15,16,18,19,20)
InChIKey
BMGSXJAWRHPRCZ-UHFFFAOYSA-N
Compound name
5-[2-(dimethylamino)ethyl]-5-phenyl-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.12698 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.13426 163.5
[M+Na]+ 298.11620 174.0
[M+NH4]+ 293.16080 170.2
[M+K]+ 314.09014 167.2
[M-H]- 274.11970 164.7
[M+Na-2H]- 296.10165 169.6
[M]+ 275.12643 165.0
[M]- 275.12753 165.0
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.