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(1R,4S,5S)-5-Methyl-4-pivaloyloxymethyl-6,6,7,7-tetramethyl-3-oxabicyclo[3.2.0]heptan-2-one
SpectraBase Compound ID DU4qb3Y1sBv
InChI InChI=1S/C17H28O4/c1-14(2,3)13(19)20-9-10-17(8)11(12(18)21-10)15(4,5)16(17,6)7/h10-11H,9H2,1-8H3/t10-,11-,17+/m1/s1
InChIKey BSRTWBAJPDCJDG-AGKHESDQSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nUQf1VH0Eb
Name (1R,4S,5S)-5-Methyl-4-pivaloyloxymethyl-6,6,7,7-tetramethyl-3-oxabicyclo[3.2.0]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-14(2,3)13(19)20-9-10-17(8)11(12(18)21-10)15(4,5)16(17,6)7/h10-11H,9H2,1-8H3/t10-,11-,17+/m1/s1
InChIKey BSRTWBAJPDCJDG-AGKHESDQSA-N
Molecular Weight 296.407 g/mol
SMILES [C@@]12([C@@](C(=O)O[C@@]2(COC(C(C)(C)C)=O)[H])([H])C(C1(C)C)(C)C)C
SPLASH splash10-001i-9000000000-51ca98152a63f290799c
Source of Spectrum F-52-1275-19
Synonyms [(1S,2S,5R)-1,6,6,7,7-pentamethyl-4-oxo-3-oxabicyclo[3.2.0]hept-2-yl]methyl pivalate
Wiley ID 794898