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4(3H)-Pyrimidinone, 6-hydroxy-5-nitro-2-[2-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]ethenyl]-
SpectraBase Compound ID 93IdQRgzqXr
InChI InChI=1S/C17H10F3N3O5/c18-17(19,20)10-3-1-2-9(8-10)12-6-4-11(28-12)5-7-13-21-15(24)14(23(26)27)16(25)22-13/h1-8H,(H2,21,22,24,25)/b7-5+
InChIKey XHZJVJCNSYSOOK-FNORWQNLSA-N
Mol Weight 393.28 g/mol
Molecular Formula C17H10F3N3O5
Exact Mass 393.057255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xYgcHULjkU
Name 4(3H)-Pyrimidinone, 6-hydroxy-5-nitro-2-[2-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]ethenyl]-
Alternate Name(s) 4-Hydroxy-5-nitro-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]-2-furanyl]ethenyl]-1H-pyrimidin-6-one 4-Hydroxy-5-nitro-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1H-pyrimidin-6-one 5-Nitro-4-oxidanyl-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1H-pyrimidin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10F3N3O5
InChI InChI=1S/C17H10F3N3O5/c18-17(19,20)10-3-1-2-9(8-10)12-6-4-11(28-12)5-7-13-21-15(24)14(23(26)27)16(25)22-13/h1-8H,(H2,21,22,24,25)/b7-5+
InChIKey XHZJVJCNSYSOOK-FNORWQNLSA-N
Molecular Weight 393.278 g/mol
SMILES N1C(=NC(=C(C1=O)N(=O)=O)O)\C=C\c1oc(-c2cc(C(F)(F)F)ccc2)cc1
SPLASH splash10-00di-5910000000-abf06924a59c922fdea3
Source of Spectrum IY-1-4488-4
Wiley ID 1652867