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6-(1-tert-butoxy-1-oxoeth-2-yl)-7-oxo-11-[(2-methoxyethoxy)methoxy]bicyclo[4.4.1]undeca-2,4,8-triene
SpectraBase Compound ID 1KjsJzuJeXN
InChI InChI=1S/C21H30O6/c1-20(2,3)27-18(23)14-21-11-6-5-8-16(9-7-10-17(21)22)19(21)26-15-25-13-12-24-4/h5-8,10-11,16,19H,9,12-15H2,1-4H3/t16-,19?,21-/m0/s1
InChIKey OQFOABIRYOWGBK-UHFFFAOYSA-N
Mol Weight 378.47 g/mol
Molecular Formula C21H30O6
Exact Mass 378.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pInjhxwv6L
Name 6-(1-tert-butoxy-1-oxoeth-2-yl)-7-oxo-11-[(2-methoxyethoxy)methoxy]bicyclo[4.4.1]undeca-2,4,8-triene
CAS Registry Number 125902-35-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O6
InChI InChI=1S/C21H30O6/c1-20(2,3)27-18(23)14-21-11-6-5-8-16(9-7-10-17(21)22)19(21)26-15-25-13-12-24-4/h5-8,10-11,16,19H,9,12-15H2,1-4H3/t16-,19?,21-/m0/s1
InChIKey OQFOABIRYOWGBK-UHFFFAOYSA-N
Molecular Weight 378.465 g/mol
SMILES [C@@]12(C([C@@](C=CC=C2)(CC=CC1=O)[H])OCOCCOC)CC(OC(C)(C)C)=O
SPLASH splash10-0a4r-9210000000-2e6f903757d6c4b7d5ad
Source of Spectrum J-55-2961-4
Synonyms tert-Butyl {11-[(2-methoxyethoxy)methoxy]-10-oxobicyclo[4.4.1]undeca-2,4,8-trien-1-yl}acetate
Wiley ID 1358801