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(1'R,2R,5S,6R)-5-[1'-(Anthracen-9"-yl)-1'-(benzoyloxy)methyl]-2-(t-butyl)-6-methyl-1,3-dioxan-4-one
SpectraBase Compound ID cPCSdVJbGr
InChI InChI=1S/C31H30O5/c1-19-25(29(33)36-30(34-19)31(2,3)4)27(35-28(32)20-12-6-5-7-13-20)26-23-16-10-8-14-21(23)18-22-15-9-11-17-24(22)26/h5-19,25,27,30H,1-4H3/t19-,25+,27-,30-/m1/s1
InChIKey UFBCLOOLLXCODU-IJTSIZSVSA-N
Mol Weight 482.58 g/mol
Molecular Formula C31H30O5
Exact Mass 482.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmYWPuhnvnq
Name (1'R,2R,5S,6R)-5-[1'-(Anthracen-9"-yl)-1'-(benzoyloxy)methyl]-2-(t-butyl)-6-methyl-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H30O5
InChI InChI=1S/C31H30O5/c1-19-25(29(33)36-30(34-19)31(2,3)4)27(35-28(32)20-12-6-5-7-13-20)26-23-16-10-8-14-21(23)18-22-15-9-11-17-24(22)26/h5-19,25,27,30H,1-4H3/t19-,25+,27-,30-/m1/s1
InChIKey UFBCLOOLLXCODU-IJTSIZSVSA-N
Molecular Weight 482.576 g/mol
SMILES C1([C@]([C@](c2c3c(cccc3)cc3c2cccc3)(OC(=O)c2ccccc2)[H])([C@@](C)(O[C@](O1)(C(C)(C)C)[H])[H])[H])=O
SPLASH splash10-0a4i-2950100000-8f50ff663aa52c68b685
Source of Spectrum H-76-472-12
Synonyms (R)-9-anthryl[(2R,4R,5S)-2-tert-butyl-4-methyl-6-oxo-1,3-dioxan-5-yl]methyl benzoate
Wiley ID 1395711