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7-(benzyloxy)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID 7MMHFgRkUE1
InChI InChI=1S/C17H20O4/c1-19-17(20-2)13-8-9-14(16(17)18)15(10-13)21-11-12-6-4-3-5-7-12/h3-9,13-15H,10-11H2,1-2H3/t13-,14+,15-/m1/s1
InChIKey MIQQOJNFUMWCAJ-QLFBSQMISA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49ZUCqjTjyp
Name 7-(benzyloxy)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one
Alternate Name(s) (1S*,4S*,7S*)-7-(Benzyloxy)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-19-17(20-2)13-8-9-14(16(17)18)15(10-13)21-11-12-6-4-3-5-7-12/h3-9,13-15H,10-11H2,1-2H3/t13-,14+,15-/m1/s1
InChIKey MIQQOJNFUMWCAJ-QLFBSQMISA-N
Molecular Weight 288.343 g/mol
SMILES C1(C([C@@]2([C@@](C[C@]1(C=C2)[H])(OCc1ccccc1)[H])[H])=O)(OC)OC
SPLASH splash10-0udl-5920000000-c948aeff3d0d7cc678a3
Source of Spectrum F-57-305-3
Wiley ID 1549213