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2.alpha.-(1-Phenyl-2,2-dimethylpropoxy)-8-oxabicyclo[3.2.1]oct-6-en-3-one isomer
SpectraBase Compound ID F7jQmcNezyn
InChI InChI=1S/C18H22O3/c1-18(2,3)17(12-7-5-4-6-8-12)21-16-14(19)11-13-9-10-15(16)20-13/h4-10,13,15-17H,11H2,1-3H3/t13-,15+,16+,17?/m0/s1
InChIKey ODXFRCNGBRBVAV-IBCJJDNGSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ifc6kwNM0
Name 2.alpha.-(1-Phenyl-2,2-dimethylpropoxy)-8-oxabicyclo[3.2.1]oct-6-en-3-one isomer
Alternate Name(s) 2-(2,2-dimethyl-1-phenylpropoxy)-8-oxabicyclo[3.2.1]oct-6-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-18(2,3)17(12-7-5-4-6-8-12)21-16-14(19)11-13-9-10-15(16)20-13/h4-10,13,15-17H,11H2,1-3H3/t13-,15+,16+,17?/m0/s1
InChIKey ODXFRCNGBRBVAV-IBCJJDNGSA-N
Molecular Weight 286.371 g/mol
SMILES [C@@]1(C(C[C@]2(O[C@@]1(C=C2)[H])[H])=O)(OC(C(C)(C)C)c1ccccc1)[H]
SPLASH splash10-06r7-3900000000-d96a5a8ac6d5b89edb02
Source of Spectrum QE-6-690-3
Wiley ID 844529