CID 208427

32150-52-0

Structural Information

Molecular Formula
C17H23N3O2
SMILES
CCN1C(=O)C(=C(N(C1=O)C2=CC=CC=C2)C)N(CC)CC
InChI
InChI=1S/C17H23N3O2/c1-5-18(6-2)15-13(4)20(14-11-9-8-10-12-14)17(22)19(7-3)16(15)21/h8-12H,5-7H2,1-4H3
InChIKey
NLGFLXKEBMNEDE-UHFFFAOYSA-N
Compound name
5-(diethylamino)-3-ethyl-6-methyl-1-phenylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

301.17902 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.18630 171.2
[M+Na]+ 324.16824 180.9
[M-H]- 300.17174 177.4
[M+NH4]+ 319.21284 184.7
[M+K]+ 340.14218 177.1
[M+H-H2O]+ 284.17628 161.6
[M+HCOO]- 346.17722 194.1
[M+CH3COO]- 360.19287 213.2
[M+Na-2H]- 322.15369 173.8
[M]+ 301.17847 176.3
[M]- 301.17957 176.3
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.