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N3-Methyl-N1-propenyl-8-p-hydroxyphenylxanthine
SpectraBase Compound ID 1larmI5fq7c
InChI InChI=1S/C15H14N4O3/c1-3-8-19-14(21)11-13(18(2)15(19)22)17-12(16-11)9-4-6-10(20)7-5-9/h3-8,20H,1-2H3,(H,16,17)/b8-3+
InChIKey YBSQJDAOHDBDNF-FPYGCLRLSA-N
Mol Weight 298.3 g/mol
Molecular Formula C15H14N4O3
Exact Mass 298.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IIQqUWg0hYB
Name N3-Methyl-N1-propenyl-8-p-hydroxyphenylxanthine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N4O3
InChI InChI=1S/C15H14N4O3/c1-3-8-19-14(21)11-13(18(2)15(19)22)17-12(16-11)9-4-6-10(20)7-5-9/h3-8,20H,1-2H3,(H,16,17)/b8-3+
InChIKey YBSQJDAOHDBDNF-FPYGCLRLSA-N
Molecular Weight 298.302 g/mol
SMILES [nH]1c(-c2ccc(cc2)O)nc2c1C(=O)N(C(N2C)=O)\C=C\C
SPLASH splash10-01qc-0190000000-79823e59ae39ea9faa86
Source of Spectrum H1-51-34-6
Synonyms 8-(4-hydroxyphenyl)-3-methyl-1-[(1E)-1-propenyl]-3,7-dihydro-1H-purine-2,6-dione
Wiley ID 817064