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(7.beta.)-7-Methyl-1-(3-oxobutyl)-8-oxabicyclo{3.2.1]octan-3-one
SpectraBase Compound ID BJTb1jJ7daZ
InChI InChI=1S/C12H18O3/c1-8-5-11-6-10(14)7-12(8,15-11)4-3-9(2)13/h8,11H,3-7H2,1-2H3/t8-,11?,12?/m1/s1
InChIKey RWRCZWXZIUEJAS-HUUUCTMMSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7V3QZb32WaO
Name (7.beta.)-7-Methyl-1-(3-oxobutyl)-8-oxabicyclo{3.2.1]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-5-11-6-10(14)7-12(8,15-11)4-3-9(2)13/h8,11H,3-7H2,1-2H3/t8-,11?,12?/m1/s1
InChIKey RWRCZWXZIUEJAS-HUUUCTMMSA-N
Molecular Weight 210.273 g/mol
SMILES C12(OC(C[C@]2(C)[H])CC(C1)=O)CCC(=O)C
SPLASH splash10-00ke-9400000000-8737826b13fb1d049fb6
Source of Spectrum K1-0-2169-14
Synonyms (7.beta.)-7-Methyl-1-(3-oxobutyl)-8-oxabicyclo{3.2.1]oct-6-en-3-one (7R)-7-methyl-1-(3-oxobutyl)-8-oxabicyclo[3.2.1]octan-3-one
Wiley ID 1588812