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(1R*,4R*)-3,3-Dimethoxy-6-butylbicyclo[2.2.2]octa-5,7-dien-2-one
SpectraBase Compound ID 8LUXcROYXiz
InChI InChI=1S/C14H20O3/c1-4-5-6-10-9-11-7-8-12(10)13(15)14(11,16-2)17-3/h7-9,11-12H,4-6H2,1-3H3/t11-,12-/m1/s1
InChIKey WMVTXZJUSYQEDH-VXGBXAGGSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 769j3zfkHNy
Name (1R*,4R*)-3,3-Dimethoxy-6-butylbicyclo[2.2.2]octa-5,7-dien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-4-5-6-10-9-11-7-8-12(10)13(15)14(11,16-2)17-3/h7-9,11-12H,4-6H2,1-3H3/t11-,12-/m1/s1
InChIKey WMVTXZJUSYQEDH-VXGBXAGGSA-N
Molecular Weight 236.311 g/mol
SMILES C1(C([C@]2([H])C=C[C@@]1(C=C2CCCC)[H])=O)(OC)OC
SPLASH splash10-0udi-0920000000-114559b175c74bfc5b45
Source of Spectrum F5-4-2277-31aN
Synonyms (1R,4R)-2-butyl-8,8-dimethoxybicyclo[2.2.2]octa-2,5-dien-7-one
Wiley ID 1732820