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5-fluoro-1-(4-hydroxy-3-nitrobenzyl)-2,4(1H,3H)-pyrimidinedione
SpectraBase Compound ID 1tZjS6RXJ1C
InChI InChI=1S/C11H8FN3O5/c12-7-5-14(11(18)13-10(7)17)4-6-1-2-9(16)8(3-6)15(19)20/h1-3,5,16H,4H2,(H,13,17,18)
InChIKey PUPUYXSTDJWALU-UHFFFAOYSA-N
Mol Weight 281.2 g/mol
Molecular Formula C11H8FN3O5
Exact Mass 281.044799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Pi6qm1v5HZ
Name 5-Fluoro-1-(4-hydroxy-3-nitrobenzyl)-2,4(1H,3H)-pyrimidinedione
CAS Registry Number 85093-36-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8FN3O5
InChI InChI=1S/C11H8FN3O5/c12-7-5-14(11(18)13-10(7)17)4-6-1-2-9(16)8(3-6)15(19)20/h1-3,5,16H,4H2,(H,13,17,18)
InChIKey PUPUYXSTDJWALU-UHFFFAOYSA-N
Molecular Weight 281.199 g/mol
SMILES Oc1c(cc(CN2C(NC(C(=C2)F)=O)=O)cc1)N(=O)=O
SPLASH splash10-0udi-7910000000-6f30c6cfb790dfe90f80
Source of Spectrum AD-0-2532-0
Synonyms 2,4(1H,3H)-pyrimidinedione, 5-fluoro-1-((4-hydroxy-3-nitrophenyl)methyl)- 5-Fluoranyl-1-[(3-nitro-4-oxidanyl-phenyl)methyl]pyrimidine-2,4-dione 5-Fluoro-1-(4-hydroxy-3-nitro-benzyl)pyrimidine-2,4-quinone 5-Fluoro-1-(4-hydroxy-3-nitrobenzyl)-uracil 5-Fluoro-1-[(4-hydroxy-3-nitro-phenyl)methyl]pyrimidine-2,4-dione Pyrimidine-2,4(1H,3H)-dione, 5-fluoro-1-(4-hydroxy-3-nitrophenyl)- Uracil, 5-fluoro-1-(4-hydroxy-3-nitrobenzyl)-
Wiley ID 1425655