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1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(phenylmethyl)-4-(trifluoromethyl)-2-pyrimidinone
SpectraBase Compound ID JC4Lvl4aYWJ
InChI InChI=1S/C17H17F3N2O5/c18-17(19,20)14-10(6-9-4-2-1-3-5-9)7-22(16(26)21-14)15-13(25)12(24)11(8-23)27-15/h1-5,7,11-13,15,23-25H,6,8H2/t11-,12-,13-,15-/m1/s1
InChIKey ILEWEFWCGQJLCQ-RGCMKSIDSA-N
Mol Weight 386.33 g/mol
Molecular Formula C17H17F3N2O5
Exact Mass 386.108956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLwr0RZbD7D
Name 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-(phenylmethyl)-4-(trifluoromethyl)-2-pyrimidinone
Alternate Name(s) 1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-5-(phenylmethyl)-4-(trifluoromethyl)pyrimidin-2-one 5-Benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-(trifluoromethyl)pyrimidin-2-one 5-Benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(trifluoromethyl)pyrimidin-2-one 5-Benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-4-(trifluoromethyl)pyrimidin-2-one
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Formula C17H17F3N2O5
InChI InChI=1S/C17H17F3N2O5/c18-17(19,20)14-10(6-9-4-2-1-3-5-9)7-22(16(26)21-14)15-13(25)12(24)11(8-23)27-15/h1-5,7,11-13,15,23-25H,6,8H2/t11-,12-,13-,15-/m1/s1
InChIKey ILEWEFWCGQJLCQ-RGCMKSIDSA-N
Molecular Weight 386.327 g/mol
SMILES O[C@@]1([C@@]([C@@](CO)(O[C@]1(N1C(N=C(C(=C1)Cc1ccccc1)C(F)(F)F)=O)[H])[H])(O)[H])[H]
SPLASH splash10-0a4i-0192000000-7485cd4b725d3a292618
Source of Spectrum KC-57-7374-13
Wiley ID 1625441