CID 208432

32150-67-7

Structural Information

Molecular Formula

C₁₅H₁₉N₃O₃

SMILES

CC1=C(C(=O)N(C(=O)N1C2=CC=C(C=C2)OC)C)N(C)C

InChI

InChI=1S/C15H19N3O3/c1-10-13(16(2)3)14(19)17(4)15(20)18(10)11-6-8-12(21-5)9-7-11/h6-9H,1-5H3

InChIKey

OKPXKOTXEVLWNV-UHFFFAOYSA-N

Compound name

5-(dimethylamino)-1-(4-methoxyphenyl)-3,6-dimethylpyrimidine-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 289.14264 Da
Monoisotopic Mass: 1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	290.149916	164.7
[M+Na]+	312.131858	176.0
[M-H]-	288.135364	171.8
[M+NH4]+	307.176463	179.0
[M+K]+	328.105798	173.5
[M+H-H2O]+	272.139900	155.6
[M+HCOO]-	334.140841	188.5
[M+CH3COO]-	348.156491	210.7
[M+Na-2H]-	310.117306	167.7
[M]+	289.14209142	171.0
[M]-	289.14318858	171.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.