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1-[2-(4-fluoro-phenyl)-ethyl]-6-hydroxy-5-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-1H-pyrimidine-2,4-dione
SpectraBase Compound ID DBM0xnDniqr
InChI InChI=1S/C20H15FN2O5/c21-12-7-5-11(6-8-12)9-10-23-18(25)15(17(24)22-20(23)27)16-13-3-1-2-4-14(13)19(26)28-16/h1-8,16,25H,9-10H2,(H,22,24,27)
InChIKey XYWSMSVUHCAFSB-UHFFFAOYSA-N
Mol Weight 382.35 g/mol
Molecular Formula C20H15FN2O5
Exact Mass 382.0965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVzpjNfUkQh
Name 1-[2-(4-fluoro-phenyl)-ethyl]-6-hydroxy-5-(3-oxo-1,3-dihydro-isobenzofuran-1-yl)-1H-pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15FN2O5
InChI InChI=1S/C20H15FN2O5/c21-12-7-5-11(6-8-12)9-10-23-18(25)15(17(24)22-20(23)27)16-13-3-1-2-4-14(13)19(26)28-16/h1-8,16,25H,9-10H2,(H,22,24,27)
InChIKey XYWSMSVUHCAFSB-UHFFFAOYSA-N
Molecular Weight 382.347 g/mol
SMILES N1C(C(=C(N(CCc2ccc(cc2)F)C1=O)O)C1OC(=O)c2c1cccc2)=O
SPLASH splash10-00di-2900000000-fb45f08cd3b97629722f
Synonyms 1-[2-(4-fluorophenyl)ethyl]-6-hydroxy-5-(3-oxo-1,3-dihydro-2-benzofuran-1-yl)-2,4(1H,3H)-pyrimidinedione
Wiley ID 1453625