Molecule

1,7-dimethyl-3H-purine-2,6-dione

Chemical Information

34 Related Dataset(s) ⌄

1,7-Dimethyl-1H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethylxanthine; LC-ESI-QQ; MS2

1,7-Dimethyl-1H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethylxanthine; LC-ESI-QQ; MS2

1,7-Dimethyl-1H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethylxanthine; LC-ESI-QQ; MS2

1,7-Dimethyl-1H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethylxanthine; LC-ESI-QQ; MS2

1,7-dimethyl-3H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethyl-1H-purine-2,6-dione, 1,7-Dimethylxanthine; LC-ESI-QTOF; MS2

1,7-dimethyl-3H-purine-2,6-dione, Paraxanthine, 2,6-Dihydroxy-1,7-dimethylpurine, 1,7-Dimethyl-1H-purine-2,6-dione, 1,7-Dimethylxanthine; LC-ESI-QTOF; MS2

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 10 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 100 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 110 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 120 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 130 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 150 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 20 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 30 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 40 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 40 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 50 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 60 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 70 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 80 V

1,7-Dimethylxanthine; LC-ESI-QTOF; MS2; 90 V

ParaXanthine; GC-EI-TOF; MS; n TMS; RT:764.472 sec

ParaXanthine; LC-ESI-IT; MS2; m/z: 181.2; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 120%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 15%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 150%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 180%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 30%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 45%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 60%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 75%; R=17500; [M+H]+

Paraxanthine; LC-ESI-QFT; MS2; CE: 90%; R=17500; [M+H]+

ParaXanthine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M+H]+

ParaXanthine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol98065
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEMBL1158	chembl
232702	surechembl
4687	pubchem
Q3565Y41V7	fdasrs
CHEBI:25858	rhea
PD000073	probes_and_drugs
FIDSAN	CCDC
3927	brenda
6872	brenda
HMDB0001860	hmdb
Molport-001-846-083	molport
50042210	bindingdb
The data in this table is sourced from UniChem at EBI.