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(4R*,4'S*,6S*,6'R*)-4,4'-Oxybis(6-methylcyclohex-2-en-1-one)
SpectraBase Compound ID JOZibKkOLEk
InChI InChI=1S/C14H18O3/c1-9-7-11(3-5-13(9)15)17-12-4-6-14(16)10(2)8-12/h3-6,9-12H,7-8H2,1-2H3/t9-,10+,11-,12+
InChIKey AJRXCMFONRLPJH-BKUVIOGVSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25ToEOnHCo1
Name (4R*,4'S*,6S*,6'R*)-4,4'-Oxybis(6-methylcyclohex-2-en-1-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-9-7-11(3-5-13(9)15)17-12-4-6-14(16)10(2)8-12/h3-6,9-12H,7-8H2,1-2H3/t9-,10+,11-,12+
InChIKey AJRXCMFONRLPJH-BKUVIOGVSA-N
Literature Reference DOI 10.1002/hlca.200900199
Molecular Weight 234.295 g/mol
SMILES [C@@]1(O[C@@]2(C=CC([C@@](C2)(C)[H])=O)[H])(C=CC([C@](C1)(C)[H])=O)[H]
SPLASH splash10-052b-9310000000-d63c2e86631378484962
Source of Spectrum H-93-173-1
Synonyms Epoxydine A (4S,6R)-6-methyl-4-(((1R,5S)-5-methyl-4-oxocyclohex-2-en-1-yl)oxy)cyclohex-2-en-1-one
Wiley ID 1785787