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(1-ALPHA,4-BETA,4A-ALPHA,9A-ALPHA)-1-CHLORO-1,3,4,4A,9,9A-HEXAHYDRO-3-OXO-4-PHENYLINDENO-[2,1-C]-PYRAN-1-CARBOXYLIC-ACID-METHYLESTER

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(1-ALPHA,4-BETA,4A-ALPHA,9A-ALPHA)-1-CHLORO-1,3,4,4A,9,9A-HEXAHYDRO-3-OXO-4-PHENYLINDENO-[2,1-C]-PYRAN-1-CARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID IgOWyaLpp
InChI InChI=1S/C20H17ClO4/c1-24-19(23)20(21)15-11-13-9-5-6-10-14(13)17(15)16(18(22)25-20)12-7-3-2-4-8-12/h2-10,15-17H,11H2,1H3/t15-,16+,17+,20+/m1/s1
InChIKey ADZLKHNMIGTSGS-YLAKUSLOSA-N
Mol Weight 356.81 g/mol
Molecular Formula C20H17ClO4
Exact Mass 356.081537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8cLDhHankUJ
Name (1-ALPHA,4-BETA,4A-ALPHA,9A-ALPHA)-1-CHLORO-1,3,4,4A,9,9A-HEXAHYDRO-3-OXO-4-PHENYLINDENO-[2,1-C]-PYRAN-1-CARBOXYLIC-ACID-METHYLESTER
CAS Registry Number 140633-69-8
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H17ClO4
InChI InChI=1S/C20H17ClO4/c1-24-19(23)20(21)15-11-13-9-5-6-10-14(13)17(15)16(18(22)25-20)12-7-3-2-4-8-12/h2-10,15-17H,11H2,1H3/t15-,16+,17+,20+/m1/s1
InChIKey ADZLKHNMIGTSGS-YLAKUSLOSA-N
Literature Reference Author J.HEGMANN,E.DITTERICH,G.HUETTNER,M.CHRISTL,E.M.PETERS,H.G.VO NSCHNERING
Literature Reference Citation CHEM.BER.,125,1913(1992)
Literature Reference DOI 10.1002/cber.19921250819
Molecular Weight 356.806 g/mol
Solvent CDCl3
Source File Reference UWCS21268