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(+/-)-(2AR,3S,8AS,8BS)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID

Compound with spectra: 1 NMR, and 1 MS (GC)

(+/-)-(2AR,3S,8AS,8BS)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID
SpectraBase Compound ID LYenDNBMvWH
InChI InChI=1S/C14H18O4/c1-14(2)5-7-3-4-8(12(15)16)11-10(7)9(6-14)18-13(11)17/h3,8-11H,4-6H2,1-2H3,(H,15,16)/t8-,9-,10-,11-/m0/s1
InChIKey MEFHOHVQBDSOPL-NAKRPEOUSA-N
Mol Weight 250.29 g/mol
Molecular Formula C14H18O4
Exact Mass 250.120509 g/mol
Enantiomer InChIKey MEFHOHVQBDSOPL-GWOFURMSSA-N

View Spectrum of (+/-)-(2AR,3S,8AS,8BS)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum B-53-408-7

View Spectrum of (+/-)-(2AR,3S,8AS,8BS)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • (2aR,3s,8aS,8bS)-7,7-Dimethyl-2-oxo-2a,3,4,6,7,8,8a,8b-octahydro-2H-benzo[cd]isobenzofuran-3-carboxylic acid
(+/-)-(2AS,3R,8AS,8BR)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID
METHYL-(2AS,3R,8AS,8BR)-7,7-DIMETHYL-2-OXO-2A,3,4,6,7,8,8A,8B-OCTAHYDRO-2H-BENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLATE
3-Oxa-tricyclo(5.4.1.0/3,11/)undec-7-en-2-one 10-(N-phenyl-carboxamide)
Indeno[1,7-bc]furan-3-carboxamide, 2,2a,4,6,7,7a,7b-octahydro-2-oxo-N-phenyl-, (2a.alpha.,3.beta.,7a.alpha.,7b.alpha.)-
Diethyl 1,3,3a,3b,8,8a-hexahydrocyclopenta[c]isobenzofuran-1,3-dione-5,5-dicarboxylate
3-[[1,3-dioxolan-2-ylmethyl(methyl)amino]methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Dimethyl (3R*,4R*)-bis(ethoxycarbonyl)-2-methylbicyclo[4.3.0]non-1(6)-ene-8,8-dicarboxylate
3,6-Methanobenzofuran-8-carboxylic acid, octahydro-2,7-dioxo-, methyl ester, (3.alpha.,3a.beta.,6.alpha.,7a.beta.,8S*)-(.+-.)-
(3aR,8aR,9aR)-8a-methyl-5-methylene-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
TVHFAQKTIGHVST-WCSPYGGUSA-N
Title Journal or Book Year
Angucyclinones Related to Ochromycinone. IV. The Structures and Reactions of Unusual Diels-Alder Adducts Formed from Maleic Anhydride and Racemic 5,5-Dimethyl-3-vinylcyclohex-2-en-1-ol Australian Journal of Chemistry 2000
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