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(1'S,2R,5S,6R)-5-(1'-Acetoxypropyl)-2-(t-butyl)-6-methyl-1,3-dioxan-4-one
SpectraBase Compound ID JtAJVum8h0d
InChI InChI=1S/C14H24O5/c1-7-10(18-9(3)15)11-8(2)17-13(14(4,5)6)19-12(11)16/h8,10-11,13H,7H2,1-6H3/t8-,10+,11+,13-/m1/s1
InChIKey XRURIOQMTSQYDT-HFHAKLMTSA-N
Mol Weight 272.34 g/mol
Molecular Formula C14H24O5
Exact Mass 272.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oo95O3gnlL
Name (1'S,2R,5S,6R)-5-(1'-Acetoxypropyl)-2-(t-butyl)-6-methyl-1,3-dioxan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O5
InChI InChI=1S/C14H24O5/c1-7-10(18-9(3)15)11-8(2)17-13(14(4,5)6)19-12(11)16/h8,10-11,13H,7H2,1-6H3/t8-,10+,11+,13-/m1/s1
InChIKey XRURIOQMTSQYDT-HFHAKLMTSA-N
Molecular Weight 272.341 g/mol
SMILES C1(O[C@](C(C)(C)C)(O[C@@]([C@]1([C@@](OC(=O)C)(CC)[H])[H])(C)[H])[H])=O
SPLASH splash10-0pkc-4940000000-5520e24eb7c9fb815e36
Source of Spectrum H-76-468-1
Synonyms (1S)-1-[(2R,4R,5S)-2-tert-butyl-4-methyl-6-oxo-1,3-dioxan-5-yl]propyl acetate
Wiley ID 1276023