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2H-Pyran-2,4-diol, 3-bromotetrahydro-6-phenyl-6-(trifluoromethyl)-, (2.alpha.,3.alpha.,4.beta.,6.beta.)-(.+-.)-
SpectraBase Compound ID JNnwTTSlxJv
InChI InChI=1S/C12H12BrF3O3/c13-9-8(17)6-11(12(14,15)16,19-10(9)18)7-4-2-1-3-5-7/h1-5,8-10,17-18H,6H2/t8-,9+,10-,11-/m0/s1
InChIKey PPFUVBBKCRTMBD-VLEAKVRGSA-N
Mol Weight 341.12 g/mol
Molecular Formula C12H12BrF3O3
Exact Mass 339.992192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PrtBGxABAg
Name 2H-Pyran-2,4-diol, 3-bromotetrahydro-6-phenyl-6-(trifluoromethyl)-, (2.alpha.,3.alpha.,4.beta.,6.beta.)-(.+-.)-
CAS Registry Number 130184-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12BrF3O3
InChI InChI=1S/C12H12BrF3O3/c13-9-8(17)6-11(12(14,15)16,19-10(9)18)7-4-2-1-3-5-7/h1-5,8-10,17-18H,6H2/t8-,9+,10-,11-/m0/s1
InChIKey PPFUVBBKCRTMBD-VLEAKVRGSA-N
Molecular Weight 341.124 g/mol
SMILES O[C@@]1([C@@]([C@](C[C@@](O1)(C(F)(F)F)c1ccccc1)(O)[H])(Br)[H])[H]
SPLASH splash10-0ab9-1900000000-7206aa6d9cb8f35b21ae
Source of Spectrum KC-1990-625-37
Synonyms (3RS,4RS,6SR)-3-bromo-6-phenyl-6-(trifluoromethyl)tetra-hydropran-2,4-diol (5S)-2-bromo-2,4-dideoxy-5-phenyl-5-(trifluoromethyl)-.beta.-L-threo-pentopyranose
Wiley ID 1334805