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6-hydroxy-5-(3-phenyl-5,6-dihydropyrazin-2-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
SpectraBase Compound ID 5CCU3lbEBQ2
InChI InChI=1S/C14H12N4O2S/c19-12-9(13(20)18-14(21)17-12)11-10(15-6-7-16-11)8-4-2-1-3-5-8/h1-5H,6-7H2,(H3,17,18,19,20,21)
InChIKey CXMYKDPXRPELMX-UHFFFAOYSA-N
Mol Weight 300.34 g/mol
Molecular Formula C14H12N4O2S
Exact Mass 300.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzsiyIhjBWC
Name 6-hydroxy-5-(3-phenyl-5,6-dihydropyrazin-2-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O2S
InChI InChI=1S/C14H12N4O2S/c19-12-9(13(20)18-14(21)17-12)11-10(15-6-7-16-11)8-4-2-1-3-5-8/h1-5H,6-7H2,(H3,17,18,19,20,21)
InChIKey CXMYKDPXRPELMX-UHFFFAOYSA-N
Instrument Name Agilent 5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3834
Molecular Weight 300.336 g/mol
SMILES N1C(NC(C(=C1O)C1=NCCN=C1c1ccccc1)=O)=S
SPLASH splash10-0udi-9701000000-27d672fb6ea5a0e98f1f
Source of Spectrum Y-57-SM30-6c
Wiley ID 1860046