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2-(t-Butyl)-5-(1'-acetoxy-3'-phenylprop-2'-ynyl)-6-methyl-1,3-dioxan-4-one
SpectraBase Compound ID Cd6nJRUL2sE
InChI InChI=1S/C20H24O5/c1-13-17(18(22)25-19(23-13)20(3,4)5)16(24-14(2)21)12-11-15-9-7-6-8-10-15/h6-10,13,16-17,19H,1-5H3
InChIKey FSMCYGWTWVICQI-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C06J5z6bH7q
Name 2-(t-Butyl)-5-(1'-acetoxy-3'-phenylprop-2'-ynyl)-6-methyl-1,3-dioxan-4-one
Alternate Name(s) 1-(2-tert-butyl-4-methyl-6-oxo-1,3-dioxan-5-yl)-3-phenyl-2-propynyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-13-17(18(22)25-19(23-13)20(3,4)5)16(24-14(2)21)12-11-15-9-7-6-8-10-15/h6-10,13,16-17,19H,1-5H3
InChIKey FSMCYGWTWVICQI-UHFFFAOYSA-N
Molecular Weight 344.407 g/mol
SMILES C1(OC(C(C)(C)C)OC(C1C(C#Cc1ccccc1)OC(=O)C)C)=O
SPLASH splash10-05mk-2930000000-900c42c96e46b306a410
Source of Spectrum H-76-2427-2
Wiley ID 1338042