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2-Amino-4-hydroxy-6-(4-methyphenyl)pyrimidine-5-carbonitrile
SpectraBase Compound ID kqib3kXfH4
InChI InChI=1S/C12H10N4O/c1-7-2-4-8(5-3-7)10-9(6-13)11(17)16-12(14)15-10/h2-5H,1H3,(H3,14,15,16,17)
InChIKey GZQOMBIGLSNVBQ-UHFFFAOYSA-N
Mol Weight 226.24 g/mol
Molecular Formula C12H10N4O
Exact Mass 226.085461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DVIQMN1hg
Name 2-Amino-4-hydroxy-6-(4-methyphenyl)pyrimidine-5-carbonitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.085460957 u
Formula C12H10N4O
InChI InChI=1S/C12H10N4O/c1-7-2-4-8(5-3-7)10-9(6-13)11(17)16-12(14)15-10/h2-5H,1H3,(H3,14,15,16,17)
InChIKey GZQOMBIGLSNVBQ-UHFFFAOYSA-N
Instrument Name FISONS GC 8000/TRIO 1012
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/jhet.4453
Molecular Weight 226.239 g/mol
Quality 976
SMILES NC1=NC(=C(C(=N1)O)C#N)C1=CC=C(C=C1)C
SPLASH splash10-000x-9610000000-96ad8079c853c8fc202f
Source of Spectrum Y-59-SM43-7d (DOI: 10.1002/jhet.4453)
Wiley ID 1892481