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1,3,3-trimethoxy-5-methyl-7-phenylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID 8lupgYNXtuW
InChI InChI=1S/C18H22O4/c1-12-11-17(20-2)15(13-8-6-5-7-9-13)10-14(12)18(21-3,22-4)16(17)19/h5-9,11,14-15H,10H2,1-4H3/t14-,15-,17+/m0/s1
InChIKey PETISHWUHDIDMD-YQQAZPJKSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmDqLR19KSB
Name 1,3,3-trimethoxy-5-methyl-7-phenylbicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-12-11-17(20-2)15(13-8-6-5-7-9-13)10-14(12)18(21-3,22-4)16(17)19/h5-9,11,14-15H,10H2,1-4H3/t14-,15-,17+/m0/s1
InChIKey PETISHWUHDIDMD-YQQAZPJKSA-N
Molecular Weight 302.370 g/mol
SMILES [C@@]12(C(C(OC)(OC)[C@@](C[C@]2(c2ccccc2)[H])(C(=C1)C)[H])=O)OC
SPLASH splash10-0a4l-8900000000-05958bb30fe76efdbdf8
Source of Spectrum F-57-307-6
Synonyms (1S*,4R*,7R*)-1,3,3-Trimethoxy-5-methyl-7-phenylbicyclo[2.2.2]oct-5-en-2-one
Wiley ID 1549199