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5-Acetyl-3,3-dimethoxy-7-phenylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID KNFmSjd8w0F
InChI InChI=1S/C18H20O4/c1-11(19)13-9-15-14(12-7-5-4-6-8-12)10-16(13)18(21-2,22-3)17(15)20/h4-9,14-16H,10H2,1-3H3/t14-,15-,16-/m0/s1
InChIKey OPSODZYZQXKMIF-JYJNAYRXSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuAwL2PXSFW
Name 5-Acetyl-3,3-dimethoxy-7-phenylbicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-11(19)13-9-15-14(12-7-5-4-6-8-12)10-16(13)18(21-2,22-3)17(15)20/h4-9,14-16H,10H2,1-3H3/t14-,15-,16-/m0/s1
InChIKey OPSODZYZQXKMIF-JYJNAYRXSA-N
Molecular Weight 300.354 g/mol
SMILES C1([C@@]2(C(C(=O)C)=C[C@](C1=O)([C@](c1ccccc1)(C2)[H])[H])[H])(OC)OC
SPLASH splash10-00di-1290000000-631bb584a60b9ff5f7c7
Source of Spectrum F-57-306-6
Synonyms (1S*,4R*,7R*)-5-Acetyl-3,3-dimethoxy-7-phenylbicyclo[2.2.2]oct-5-en-2-one
Wiley ID 1549204