CID 208428

Brn 0755011

Structural Information

Molecular Formula
C16H19N3O2
SMILES
CC1=C(C(=O)N(C(=O)N1C2=CC=CC=C2)CC=C)N(C)C
InChI
InChI=1S/C16H19N3O2/c1-5-11-18-15(20)14(17(3)4)12(2)19(16(18)21)13-9-7-6-8-10-13/h5-10H,1,11H2,2-4H3
InChIKey
IDKUACLJPBLSHH-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-6-methyl-1-phenyl-3-prop-2-enylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

285.14774 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.15502 166.2
[M+Na]+ 308.13696 181.2
[M+NH4]+ 303.18156 172.5
[M+K]+ 324.11090 174.2
[M-H]- 284.14046 169.6
[M+Na-2H]- 306.12241 174.0
[M]+ 285.14719 169.2
[M]- 285.14829 169.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.