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(2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylethyl]-1,3-dioxan-4-one
SpectraBase Compound ID LZ18yhpoJ4R
InChI InChI=1S/C17H24O3/c1-11(13-9-7-6-8-10-13)14-12(2)19-16(17(3,4)5)20-15(14)18/h6-12,14,16H,1-5H3/t11-,12-,14-,16-/m1/s1
InChIKey FRQMCZKALATUEZ-ZNEHSRBWSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICA0VoqCYK5
Name (2R,5R,6R)-2-tert-butyl-6-methyl-5-[(1S)-1-phenylethyl]-1,3-dioxan-4-one
CAS Registry Number 129287-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-11(13-9-7-6-8-10-13)14-12(2)19-16(17(3,4)5)20-15(14)18/h6-12,14,16H,1-5H3/t11-,12-,14-,16-/m1/s1
InChIKey FRQMCZKALATUEZ-ZNEHSRBWSA-N
Molecular Weight 276.376 g/mol
SMILES C1([C@@]([C@@](C)(O[C@](O1)(C(C)(C)C)[H])[H])([C@@](c1ccccc1)(C)[H])[H])=O
SPLASH splash10-0597-1900000000-cef43b9d8e437595855a
Source of Spectrum K-123-2423-25
Wiley ID 1280358