Isocaffeine

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CATAPS519324A
CAS519-32-4
Structure
IUPAC Name1,3,9-trimethylpurine-2,6-dione
Molecular Weight194.19
Molecular FormulaC8H10N4O2
Canonical SMILESCN1C(=O)N(C)c2c(ncn2C)C1=O
InChIInChI=1S/C8H10N4O2/c1-10-4-9-5-6(10)11(2)8(14)12(3)7(5)13/h4H,1-3H3
Accurate Mass194.0804
FormatNeat
Product TypeImpurity
ShippingRoom Temperature
Size100MG
Storage Conditions2-8°C Fridge/Coldroom
SubcategoryImpurity standards
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