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1-Methyluric acid

View entire compound with spectra: 2 NMR, and 2 FTIR

1-Methyluric acid
SpectraBase Compound ID KtXBqOtVtIN
InChI InChI=1S/C6H6N4O3/c1-10-4(11)2-3(9-6(10)13)8-5(12)7-2/h1H3,(H,9,13)(H2,7,8,12)
InChIKey QFDRTQONISXGJA-UHFFFAOYSA-N
Mol Weight 182.14 g/mol
Molecular Formula C6H6N4O3
Exact Mass 182.04399 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KS6cuiQLmOg
Name 1-Methyluric acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 360236
CAS Registry Number 708-79-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6N4O3
InChI InChI=1S/C6H6N4O3/c1-10-4(11)2-3(9-6(10)13)8-5(12)7-2/h1H3,(H,9,13)(H2,7,8,12)
InChIKey QFDRTQONISXGJA-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent D2O & NaOD
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-Methyl-2,6,8-trihydroxypurine, 1-U, 1MUA
Wiley ID SIAL_13CNMR_007467