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(2R,3S,4R,5R)-2-Hydroxymethyl-5-(4-trifluoromethyl-pyrazolo[3,4-b]pyridin-1-yl)-tetrahydro-furan-3,4-diol

View entire compound with spectra: 1 MS (GC)

(2R,3S,4R,5R)-2-Hydroxymethyl-5-(4-trifluoromethyl-pyrazolo[3,4-b]pyridin-1-yl)-tetrahydro-furan-3,4-diol
SpectraBase Compound ID JLpjQ6iCD3Z
InChI InChI=1S/C12H12F3N3O4/c13-12(14,15)6-1-2-16-10-5(6)3-17-18(10)11-9(21)8(20)7(4-19)22-11/h1-3,7-9,11,19-21H,4H2/t7-,8-,9-,11-/m1/s1
InChIKey NMKCTIIHTCQJCG-TURQNECASA-N
Mol Weight 319.24 g/mol
Molecular Formula C12H12F3N3O4
Exact Mass 319.07799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9buuBytDY4K
Name (2R,3S,4R,5R)-2-Hydroxymethyl-5-(4-trifluoromethyl-pyrazolo[3,4-b]pyridin-1-yl)-tetrahydro-furan-3,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12F3N3O4
InChI InChI=1S/C12H12F3N3O4/c13-12(14,15)6-1-2-16-10-5(6)3-17-18(10)11-9(21)8(20)7(4-19)22-11/h1-3,7-9,11,19-21H,4H2/t7-,8-,9-,11-/m1/s1
InChIKey NMKCTIIHTCQJCG-TURQNECASA-N
Molecular Weight 319.240 g/mol
SMILES O[C@@]1([C@](O[C@]([C@@]1(O)[H])([n]1c2c(c(C(F)(F)F)ccn2)cn1)[H])(CO)[H])[H]
SPLASH splash10-03xr-1982000000-da6ad8e818a6bb2dcf4e
Source of Spectrum F4-41-739-21
Synonyms 1-(beta.,D-ribofuranoyl)-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridine (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[4-(trifluoromethyl)-1-pyrazolo[3,4-b]pyridinyl]oxolane-3,4-diol (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]tetrahydrofuran-3,4-diol (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[4-(trifluoromethyl)pyrazolo[3,4-b]pyridin-1-yl]oxolane-3,4-diol
Wiley ID 1671982