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1,4-Dihydroxy-3-( 6'-hydroxy-4'-oxo-2'-thioxo-1',2',3',4'-tetrahydro-5'-pyrimidinyl)-2-naphthoniteile -
SpectraBase Compound ID GQHFqo8xyPY
InChI InChI=1S/C15H9N3O4S/c16-5-8-9(10-13(21)17-15(23)18-14(10)22)12(20)7-4-2-1-3-6(7)11(8)19/h1-4,19-20H,(H3,17,18,21,22,23)
InChIKey CIZHMKOJFFGYLZ-UHFFFAOYSA-N
Mol Weight 327.31 g/mol
Molecular Formula C15H9N3O4S
Exact Mass 327.031377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERhbDOKvVkl
Name 1,4-Dihydroxy-3-( 6'-hydroxy-4'-oxo-2'-thioxo-1',2',3',4'-tetrahydro-5'-pyrimidinyl)-2-naphthoniteile -
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9N3O4S
InChI InChI=1S/C15H9N3O4S/c16-5-8-9(10-13(21)17-15(23)18-14(10)22)12(20)7-4-2-1-3-6(7)11(8)19/h1-4,19-20H,(H3,17,18,21,22,23)
InChIKey CIZHMKOJFFGYLZ-UHFFFAOYSA-N
Molecular Weight 327.314 g/mol
SMILES N1C(NC(C(=C1O)c1c(c(O)c2c(c1O)cccc2)C#N)=O)=S
SPLASH splash10-004i-0469000000-df3fc0fd5a8b0edc42de
Source of Spectrum D8-337-137-19
Synonyms 1,4-Dihydroxy-3-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-2-naphthalenecarbonitrile 1,4-Dihydroxy-3-(6-hydroxy-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)naphthalene-2-carbonitrile 1,4-Dihydroxy-3-(6-hydroxy-4-oxo-2-thioxo-1H-pyrimidin-5-yl)naphthalene-2-carbonitrile 1,4-Dihydroxy-3-(6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-2-naphthonitrile 1,4-Bis(oxidanyl)-3-(6-oxidanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)naphthalene-2-carbonitrile 1,4-Dihydroxy-3-(6-hydroxy-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-naphthonitrile
Wiley ID 1551148