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(1'RS,3'RS,6'SR,7'SR,10'SR,11'RS,12'RS,13'RS)-2-[6'-(3'',4''-methylenedioxyphenyl)tetracyclo[5.4.2.03,13.010,12]trideca-4',8'-dien-11'-yl]acetic acid
SpectraBase Compound ID G8xGH3PsGXq
InChI InChI=1S/C22H22O4/c23-20(24)9-16-15-5-4-14-13(3-1-12-7-17(16)22(15)21(12)14)11-2-6-18-19(8-11)26-10-25-18/h1-6,8,12-17,21-22H,7,9-10H2,(H,23,24)/t12-,13+,14+,15-,16-,17?,21-,22-/m1/s1
InChIKey ABOYVNQPUIGLSV-STWMBOIDSA-N
Mol Weight 350.41 g/mol
Molecular Formula C22H22O4
Exact Mass 350.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKjXpjNBKOE
Name (1'RS,3'RS,6'SR,7'SR,10'SR,11'RS,12'RS,13'RS)-2-[6'-(3'',4''-METHYLENEDIOXY-PHENYL)-TETRACYCLO-[5.4.2.0(3,13).0(10,12)]-TRIDECA-4',8'-DIEN-11'-YL]-ACETIC-ACID-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O4
InChI InChI=1S/C22H22O4/c23-20(24)9-16-15-5-4-14-13(3-1-12-7-17(16)22(15)21(12)14)11-2-6-18-19(8-11)26-10-25-18/h1-6,8,12-17,21-22H,7,9-10H2,(H,23,24)/t12-,13+,14+,15-,16-,17?,21-,22-/m1/s1
InChIKey ABOYVNQPUIGLSV-STWMBOIDSA-N
Literature Reference Author J.E.BANFIELD,D.S.C.BLACK,D.J.COLLINS,B.P.M.HYLAND,J.J.LEE,S. R.PRANOWO
Literature Reference Citation AUSTR.J.CHEM.,47,587(1994)
Literature Reference DOI 10.1071/ch9940587
Molecular Weight 350.414 g/mol
Solvent CDCl3
Source File Reference UWRK1496