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4,7-Epoxy-2H-cyclohepta[b]furan-2-one, octahydro-3a,8-dimethyl-3-methylene-, (3a.alpha.,4.beta.,7.beta.,8.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID B4dEf2VAImq
InChI InChI=1S/C12H16O3/c1-6-8-4-5-9(14-8)12(3)7(2)11(13)15-10(6)12/h6,8-10H,2,4-5H2,1,3H3
InChIKey MXLOFOLIVHIJFO-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 442Yzg5cpf
Name 4,7-Epoxy-2H-cyclohepta[b]furan-2-one, octahydro-3a,8-dimethyl-3-methylene-, (3a.alpha.,4.beta.,7.beta.,8.alpha.,8a.alpha.)-(.+-.)-
Alternate Name(s) 2,7-Dimethyl-3-methylene-5,11-dioxatricyclo[6.2.1.0(2,6)]undecan-4-one
CAS Registry Number 121878-62-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-6-8-4-5-9(14-8)12(3)7(2)11(13)15-10(6)12/h6,8-10H,2,4-5H2,1,3H3
InChIKey MXLOFOLIVHIJFO-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C12(C(OC(C2=C)=O)C(C)C2OC1CC2)C
SPLASH splash10-014i-5900000000-273770638214cf18e13e
Source of Spectrum F-44-5158-13
Wiley ID 1206880