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(4R,5R)-4,5-dicyclohexyl-2-[(1R)-1-(2,3,4,5,6-pentafluorophenyl)-2-phenyl-ethyl]-1,3,2-dioxaborolane
SpectraBase Compound ID CWcMmaw3BkP
InChI InChI=1S/C28H32BF5O2/c30-22-21(23(31)25(33)26(34)24(22)32)20(16-17-10-4-1-5-11-17)29-35-27(18-12-6-2-7-13-18)28(36-29)19-14-8-3-9-15-19/h1,4-5,10-11,18-20,27-28H,2-3,6-9,12-16H2/t20-,27-,28-/m1/s1
InChIKey CPGVSXWRKKTFLM-MVCUUDKNSA-N
Mol Weight 506.4 g/mol
Molecular Formula C28H32BF5O2
Exact Mass 506.241551 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhVkRfMUjZl
Name (4R,5R)-4,5-dicyclohexyl-2-[(1R)-1-(2,3,4,5,6-pentafluorophenyl)-2-phenyl-ethyl]-1,3,2-dioxaborolane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32BF5O2
InChI InChI=1S/C28H32BF5O2/c30-22-21(23(31)25(33)26(34)24(22)32)20(16-17-10-4-1-5-11-17)29-35-27(18-12-6-2-7-13-18)28(36-29)19-14-8-3-9-15-19/h1,4-5,10-11,18-20,27-28H,2-3,6-9,12-16H2/t20-,27-,28-/m1/s1
InChIKey CPGVSXWRKKTFLM-MVCUUDKNSA-N
Molecular Weight 506.364 g/mol
SMILES [C@]1(OB(O[C@@]1(C1CCCCC1)[H])[C@@](c1c(c(F)c(c(c1F)F)F)F)(Cc1ccccc1)[H])(C1CCCCC1)[H]
SPLASH splash10-000x-9220020000-64eec8f59cccd34a4b77
Source of Spectrum J-65-8124-3
Synonyms (4R,5R)-4,5-dicyclohexyl-2-[(1R)-1-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-2-phenyl-ethyl]-1,3,2-dioxaborolane
Wiley ID 1533821