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7,9-Dibromo-8-hydroxy-2-phenyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
SpectraBase Compound ID HzluhyASR5Y
InChI InChI=1S/C17H8Br2N2O4/c18-9-6-8-12(22)10-16(24)20-15(7-4-2-1-3-5-7)21-17(10)25-14(8)11(19)13(9)23/h1-6,23H,(H,20,21,24)
InChIKey MHGATEZYEJDLGU-UHFFFAOYSA-N
Mol Weight 464.07 g/mol
Molecular Formula C17H8Br2N2O4
Exact Mass 461.885083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AGFFtInDIJ
Name 7,9-Dibromo-8-hydroxy-2-phenyl-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 461.885082742 u
Formula C17H8Br2N2O4
InChI InChI=1S/C17H8Br2N2O4/c18-9-6-8-12(22)10-16(24)20-15(7-4-2-1-3-5-7)21-17(10)25-14(8)11(19)13(9)23/h1-6,23H,(H,20,21,24)
InChIKey MHGATEZYEJDLGU-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4542
Molecular Weight 464.069 g/mol
Quality 445
SMILES OC=1C(=CC=2C(C=3C(NC(=NC3OC2C1Br)C1=CC=CC=C1)=O)=O)Br
SPLASH splash10-06tr-4202900000-1adfd4a45a72a27041aa
Source of Spectrum Y-59-2080-5 (DOI: 10.1002/jhet.4542)
Wiley ID 1892413