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2,3-Dioxabicyclo[2.2.2]octane, ethanone deriv.
SpectraBase Compound ID HmarS7vozv0
InChI InChI=1S/C11H16O3/c1-7-5-9-6-10(3,4)11(7,8(2)12)14-13-9/h5,9H,6H2,1-4H3/t9-,11-/m1/s1
InChIKey NHJGYLUSOPZVAM-MWLCHTKSSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fqhkVs8vNP
Name 2,3-Dioxabicyclo[2.2.2]octane, ethanone deriv.
CAS Registry Number 102677-02-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-7-5-9-6-10(3,4)11(7,8(2)12)14-13-9/h5,9H,6H2,1-4H3/t9-,11-/m1/s1
InChIKey NHJGYLUSOPZVAM-MWLCHTKSSA-N
Molecular Weight 196.246 g/mol
SMILES [C@@]12(C(=C[C@@](OO2)(CC1(C)C)[H])C)C(=O)C
SPLASH splash10-0f6y-9400000000-55e5187169a1744b70a2
Source of Spectrum H-68-1213-12
Synonyms Ethanone, 1-(6,7,7-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl)-, (.+-.)- 1-(6,7,7-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-1-yl)ethanone Methyl 6,7,7-trimethyl-2,3-dioxabicylo[2.2.2]oct-5-enyl ketone
Wiley ID 1193164