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2-Amino-4-hydroxy-6-(4-hydroxyphenyl) pyrimidine-5-carbonitrile
SpectraBase Compound ID CrCZckZA2aT
InChI InChI=1S/C11H8N4O2/c12-5-8-9(14-11(13)15-10(8)17)6-1-3-7(16)4-2-6/h1-4,16H,(H3,13,14,15,17)
InChIKey UDYLYLYSBYLZEO-UHFFFAOYSA-N
Mol Weight 228.21 g/mol
Molecular Formula C11H8N4O2
Exact Mass 228.064726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXVpM7hlbOv
Name 2-Amino-4-hydroxy-6-(4-hydroxyphenyl) pyrimidine-5-carbonitrile
Appearance Yellow solid
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Exact Mass 228.064725512 u
Formula C11H8N4O2
InChI InChI=1S/C11H8N4O2/c12-5-8-9(14-11(13)15-10(8)17)6-1-3-7(16)4-2-6/h1-4,16H,(H3,13,14,15,17)
InChIKey UDYLYLYSBYLZEO-UHFFFAOYSA-N
Instrument Name FISONS GC 8000/TRIO 1014
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/jhet.4453
Molecular Weight 228.211 g/mol
Quality 805
SMILES NC1=NC(C2=CC=C(C=C2)O)=C(C(=N1)O)C#N
SPLASH splash10-05ox-9510000000-fcdae0784864d4806fdc
Source of Spectrum Y-59-SM48-7g (DOI: 10.1002/jhet.4453)
Wiley ID 1892483