For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(+/-)-(2AS,3R,5AR,8AS,8BR)-5,5A-DIHYDROXY-7,7-DIMETHYL-2-OXOPERHYDROBENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID

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

(+/-)-(2AS,3R,5AR,8AS,8BR)-5,5A-DIHYDROXY-7,7-DIMETHYL-2-OXOPERHYDROBENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID
SpectraBase Compound ID DKBPNEioM0b
InChI InChI=1S/C14H20O6/c1-13(2)4-7-10-9(12(18)20-7)6(11(16)17)3-8(15)14(10,19)5-13/h6-10,15,19H,3-5H2,1-2H3,(H,16,17)/t6-,7+,8+,9-,10-,14-/m1/s1
InChIKey BMQPZDQWQALWHT-LVJJOLLQSA-N
Mol Weight 284.31 g/mol
Molecular Formula C14H20O6
Exact Mass 284.125988 g/mol
Enantiomer InChIKey BMQPZDQWQALWHT-WFOVXQATSA-N

View Spectrum of (+/-)-(2AS,3R,5AR,8AS,8BR)-5,5A-DIHYDROXY-7,7-DIMETHYL-2-OXOPERHYDROBENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum B-53-408-9

View Spectrum of (+/-)-(2AS,3R,5AR,8AS,8BR)-5,5A-DIHYDROXY-7,7-DIMETHYL-2-OXOPERHYDROBENZO-[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
  • (2aS,3R,5S,5aS,8aS,8bS)-7,7-Dimethyl-5,5a-dihydroxy-2-oxoperhydrobenzo[cd]isobenzofuran-3-carboxylic acid
(+/-)-(2AS,3R,5S,5AR,8AS,8BR)-5,5A-DIHYDROXY-7,7-DIMETHYL-2-OXOPERHYDROBENZO-[CD]-ISOBENZOFURAN-3-CARBOXYLIC-ACID
1,6-bis[(Benzoyloxy)methyl]-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
1,3-Dimethyl-3-hydroxy-bicyclo(2.2.2)octan-2-one-7,8-dicarboxylic anhydride
1-[(Benzoyloxy)methyl]-6-[(4'-phenylbutanoyl)oxymethyl]-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
CINATRIN-A-METHYLESTER
1,3-Bis(2-methoxyphenyl)-9H-xanthen-9-one
CUMAMBRANOLIDE 8-B-ANGELOYLOXY
Angeloyl-cumambrin-B
CINATRIN-B-METHYLESTER
17-BETA-ETHOXY-3-METHOXY-6-OXAESTRA-1,3,5(10)-TRIEN-7-ONE
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
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.