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(1S,4S,8R)-(1S,4S,8S)-8-Methoxy-1,8-dimethyl-6-(2-methylphenyl)bicyclo[2.2.2]oct-5-en-2-one

View entire compound with spectra: 1 MS (GC)

(1S,4S,8R)-(1S,4S,8S)-8-Methoxy-1,8-dimethyl-6-(2-methylphenyl)bicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID FTm6RnUWLW
InChI InChI=1S/C18H22O3/c1-17-11-18(2,21-4)12(10-16(17)19)9-14(17)13-7-5-6-8-15(13)20-3/h5-9,12H,10-11H2,1-4H3/t12-,17+,18+/m1/s1
InChIKey LYKQQNIOIVCXEO-UUWFMWQGSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EqSPDwwkCY
Name (1S,4S,8R)-(1S,4S,8S)-8-Methoxy-1,8-dimethyl-6-(2-methylphenyl)bicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-17-11-18(2,21-4)12(10-16(17)19)9-14(17)13-7-5-6-8-15(13)20-3/h5-9,12H,10-11H2,1-4H3/t12-,17+,18+/m1/s1
InChIKey LYKQQNIOIVCXEO-UUWFMWQGSA-N
Molecular Weight 286.371 g/mol
SMILES C=1([C@]2(C(=O)C[C@@](C1)([C@](OC)(C)C2)[H])C)c1c(OC)cccc1
SPLASH splash10-03di-0190000000-fe3d50ffb3c6d0f14383
Source of Spectrum KC-0-1309-17
Synonyms (1S,4S,8R)-(1S,4S,8S)-8-Methoxy-1,8-dimethyl-6-(2-methoxyphenyl)bicyclo[2.2.2]oct-5-en-2-one
Wiley ID 785903