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(1S*,4R*,5R)-8-Hydroxy-1,3,3-trimethyl-6-ethoxycarbonylbicyclo[2.2.2]oct-5-en-2-one
SpectraBase Compound ID GSrFKfY5ilI
InChI InChI=1S/C14H20O4/c1-5-18-11(16)9-6-8-10(15)7-14(9,4)12(17)13(8,2)3/h6,8,10,15H,5,7H2,1-4H3/t8-,10+,14-/m0/s1
InChIKey QRRNCRFBYVAULD-HNXYLICVSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K99vUYWhTaE
Name (1S*,4R*,5R)-8-Hydroxy-1,3,3-trimethyl-6-ethoxycarbonylbicyclo[2.2.2]oct-5-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-5-18-11(16)9-6-8-10(15)7-14(9,4)12(17)13(8,2)3/h6,8,10,15H,5,7H2,1-4H3/t8-,10+,14-/m0/s1
InChIKey QRRNCRFBYVAULD-HNXYLICVSA-N
Molecular Weight 252.310 g/mol
SMILES O[C@]1([C@]2(C(C([C@](C(=C2)C(=O)OCC)(C1)C)=O)(C)C)[H])[H]
SPLASH splash10-014l-5900000000-52a0580db4b014c44513
Source of Spectrum F-69-453-8
Synonyms Ethyl 8-hydroxy-1,5,5-trimethyl-6-oxobicyclo[2.2.2]oct-2-ene-2-carboxylate
Wiley ID 1594557