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(+)-(2S,6R)-2-(tert-Butyl)-6-phenyl-1,3-dioxan-4-one
SpectraBase Compound ID 3aZWe7pQocT
InChI InChI=1S/C14H18O3/c1-14(2,3)13-16-11(9-12(15)17-13)10-7-5-4-6-8-10/h4-8,11,13H,9H2,1-3H3/t11-,13+/m1/s1
InChIKey CILCPRULVYKAPY-YPMHNXCESA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tOwyr14ds
Name (+)-(2S,6R)-2-(tert-Butyl)-6-phenyl-1,3-dioxan-4-one
Alternate Name(s) (2S,6R)-2-(tert-butyl)-6-phenyl-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-14(2,3)13-16-11(9-12(15)17-13)10-7-5-4-6-8-10/h4-8,11,13H,9H2,1-3H3/t11-,13+/m1/s1
InChIKey CILCPRULVYKAPY-YPMHNXCESA-N
Literature Reference DOI 10.1002/hlca.200390063
Molecular Weight 234.295 g/mol
SMILES [C@]1(O[C@](CC(O1)=O)(c1ccccc1)[H])(C(C)(C)C)[H]
SPLASH splash10-0kcr-4900000000-ae1afd8f8ba7f01807a1
Source of Spectrum H-86-652-17
Wiley ID 1785356