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6-(4-Methylphenyl)pyrimidine-2-thione-3-acetic acid
SpectraBase Compound ID 66PVZzTZuqn
InChI InChI=1S/C13H12N2O2S/c1-9-2-4-10(5-3-9)11-6-7-15(8-12(16)17)13(18)14-11/h2-7H,8H2,1H3,(H,16,17)
InChIKey BPPGEHSNDAVELK-UHFFFAOYSA-N
Mol Weight 260.31 g/mol
Molecular Formula C13H12N2O2S
Exact Mass 260.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCOeoKcPFuA
Name 6-(4-Methylphenyl)pyrimidine-2-thione-3-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2S
InChI InChI=1S/C13H12N2O2S/c1-9-2-4-10(5-3-9)11-6-7-15(8-12(16)17)13(18)14-11/h2-7H,8H2,1H3,(H,16,17)
InChIKey BPPGEHSNDAVELK-UHFFFAOYSA-N
Molecular Weight 260.311 g/mol
SMILES OC(CN1C(N=C(c2ccc(cc2)C)C=C1)=S)=O
SPLASH splash10-014i-0490000000-7e910f5919436ed2ef4e
Source of Spectrum SO-0-817-7
Synonyms (4-(4-methylphenyl)-2-thioxo-1(2H)-pyrimidinyl)acetic acid
Wiley ID 1540202