isocaffeine (Q1674397)

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chemical compound
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Language Label Description Also known as
English
isocaffeine
chemical compound

    Statements

    mass
    194.080376±0 dalton
    1 reference
    stated in
    PubChem
    PubChem CID
    1326
    language of work or name
    English
    title
    Isocaffeine (English)
    retrieved
    19 September 2016
    chemical formula
    C₈H₁₀N₄O₂
    1 reference
    stated in
    PubChem
    PubChem CID
    1326
    language of work or name
    English
    title
    Isocaffeine (English)
    retrieved
    19 September 2016
    canonical SMILES
    CN1C=NC2=C1N(C(=O)N(C2=O)C)C
    1 reference
    stated in
    PubChem
    PubChem CID
    1326
    language of work or name
    English
    title
    Isocaffeine (English)
    retrieved
    19 September 2016

    Identifiers

    NSC number
    28332
    0 references
    EC number
    208-267-7
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.007.517
    retrieved
    27 December 2018
    title
    3,9-dihydro-1,3,9-trimethyl-1H-purine-2,6-dione (English)
    quotation
    CAS no.: 519-32-4 (English)
    ECHA Substance Infocard ID
    100.007.517
    1 reference
    stated in
    ECHA Substance Infocard database
    ECHA Substance Infocard ID
    100.007.517
    retrieved
    27 December 2018
    title
    3,9-dihydro-1,3,9-trimethyl-1H-purine-2,6-dione (English)
    quotation
    CAS no.: 519-32-4 (English)
     
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