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1-{(2R,3R,4R,5R)-4-Benzoyloxymethyl-5-(2-hydroxyethyl)-3-[(m-trifluoromethyl)benzoyloxy]tetrahydrofuran-2-yl}uracil
SpectraBase Compound ID KdR2AThr5bs
InChI InChI=1S/C26H23F3N2O8/c27-26(28,29)17-8-4-7-16(13-17)24(35)39-21-18(14-37-23(34)15-5-2-1-3-6-15)19(10-12-32)38-22(21)31-11-9-20(33)30-25(31)36/h1-9,11,13,18-19,21-22,32H,10,12,14H2,(H,30,33,36)/t18-,19-,21-,22-/m1/s1
InChIKey KUYLCRXYQVCUGL-UGESXGAOSA-N
Mol Weight 548.47 g/mol
Molecular Formula C26H23F3N2O8
Exact Mass 548.14065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AvJIHdMeVa
Name 1-{(2R,3R,4R,5R)-4-Benzoyloxymethyl-5-(2-hydroxyethyl)-3-[(m-trifluoromethyl)benzoyloxy]tetrahydrofuran-2-yl}uracil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23F3N2O8
InChI InChI=1S/C26H23F3N2O8/c27-26(28,29)17-8-4-7-16(13-17)24(35)39-21-18(14-37-23(34)15-5-2-1-3-6-15)19(10-12-32)38-22(21)31-11-9-20(33)30-25(31)36/h1-9,11,13,18-19,21-22,32H,10,12,14H2,(H,30,33,36)/t18-,19-,21-,22-/m1/s1
InChIKey KUYLCRXYQVCUGL-UGESXGAOSA-N
Molecular Weight 548.471 g/mol
SMILES OCC[C@@]1([C@]([C@]([C@](N2C(NC(C=C2)=O)=O)(O1)[H])(OC(c1cc(C(F)(F)F)ccc1)=O)[H])(COC(=O)c1ccccc1)[H])[H]
SPLASH splash10-004i-3940200000-d748dc740cbca2637e17
Source of Spectrum J-67-4007-5
Synonyms (2R,3R,4R,5R)-4-[(benzoyloxy)methyl]-2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-5-(2-hydroxyethyl)oxolan-3-yl 3-(trifluoromethyl)benzoate 3-(trifluoromethyl)benzoic acid [(2R,3R,4R,5R)-4-(benzoyloxymethyl)-2-(2,4-dioxo-1-pyrimidinyl)-5-(2-hydroxyethyl)-3-oxolanyl] ester [(2R,3R,4R,5R)-4-(benzoyloxymethyl)-2-(2,4-dioxopyrimidin-1-yl)-5-(2-hydroxyethyl)oxolan-3-yl] 3-(trifluoromethyl)benzoate [(2R,3R,4R,5R)-4-(benzoyloxymethyl)-2-(2,4-dioxopyrimidin-1-yl)-5-(2-hydroxyethyl)tetrahydrofuran-3-yl] 3-(trifluoromethyl)benzoate [(2R,3R,4R,5R)-2-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-5-(2-hydroxyethyl)-4-(phenylcarbonyloxymethyl)oxolan-3-yl] 3-(trifluoromethyl)benzoate
Wiley ID 1570065