CID 3041245

53727-38-1

Structural Information

Molecular Formula
C13H15N3O2
SMILES
CN1C(=O)C(=CN(C1=O)C2=CC=CC=C2)N(C)C
InChI
InChI=1S/C13H15N3O2/c1-14(2)11-9-16(10-7-5-4-6-8-10)13(18)15(3)12(11)17/h4-9H,1-3H3
InChIKey
NHNWBHDARPZSAQ-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-3-methyl-1-phenylpyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.11642 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.12370 152.9
[M+Na]+ 268.10564 163.5
[M-H]- 244.10914 159.5
[M+NH4]+ 263.15024 168.5
[M+K]+ 284.07958 160.6
[M+H-H2O]+ 228.11368 143.9
[M+HCOO]- 290.11462 177.3
[M+CH3COO]- 304.13027 200.0
[M+Na-2H]- 266.09109 158.4
[M]+ 245.11587 156.3
[M]- 245.11697 156.3
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.