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Ethanone, 1-[3-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)oxiranyl]-, [2R-[2.alpha.,3.beta.(1R*,5S*)]]-
SpectraBase Compound ID 7pJ9wlcQAUQ
InChI InChI=1S/C14H22O2/c1-8-6-7-9(2)14(4,5)11(8)13-12(16-13)10(3)15/h6,9,11-13H,7H2,1-5H3/t9-,11-,12-,13-/m0/s1
InChIKey FPECDAJIQRWOLQ-BQUFFADESA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Lk0hVdU6c0
Name Ethanone, 1-[3-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)oxiranyl]-, [2R-[2.alpha.,3.beta.(1R*,5S*)]]-
CAS Registry Number 124886-69-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-8-6-7-9(2)14(4,5)11(8)13-12(16-13)10(3)15/h6,9,11-13H,7H2,1-5H3/t9-,11-,12-,13-/m0/s1
InChIKey FPECDAJIQRWOLQ-BQUFFADESA-N
Molecular Weight 222.328 g/mol
SMILES [C@@]1(O[C@]1(C(=O)C)[H])([C@]1(C([C@@](C)(CC=C1C)[H])(C)C)[H])[H]
SPLASH splash10-052f-9100000000-36cd63b4408c391d09bb
Source of Spectrum H-72-1413-12
Synonyms (1'R,3R,4S,5'S)-3,4-epoxy-4-[2',5',6',6'-tetramethylcyclohex-2'-en-1'-yl]butan-2-one 1-{(2R,3S)-3-[(1R,5S)-2,5,6,6-tetramethyl-2-cyclohexen-1-yl]oxiranyl}ethanone 3,4-Epoxy-4-[2',5',6',6'-tetramethylcyclohex-2'-en-1'-yl]butan-2-one 7,8-Epoxy-cis-.alpha.-dihydroirone
Wiley ID 1222921