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[3R-(3-BETA,3A-ALPHA,5AR,7A-ALPHA,11A-BETA,11B-ALPHA)]-(+)-1,3,3A,6,7,7A,8,9,10,11,11A,11B-DODECAHYDRO-8,8,11A-TRIMETHYL-2H-CYCLOBUTA-[J]-PHENANTHREN-3-CARBOXY

View entire compound with spectra: 1 NMR

[3R-(3-BETA,3A-ALPHA,5AR,7A-ALPHA,11A-BETA,11B-ALPHA)]-(+)-1,3,3A,6,7,7A,8,9,10,11,11A,11B-DODECAHYDRO-8,8,11A-TRIMETHYL-2H-CYCLOBUTA-[J]-PHENANTHREN-3-CARBOXY
SpectraBase Compound ID 4vrp7EPxq3P
InChI InChI=1S/C20H30O2/c1-18(2)9-4-10-19(3)15(18)8-12-20-11-7-14(20)13(17(21)22)5-6-16(19)20/h7,11,13-16H,4-6,8-10,12H2,1-3H3,(H,21,22)/t13-,14-,15+,16-,19+,20+/m1/s1
InChIKey JXXLEZKZTVNNOW-GPGBYLDCSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIStUIkhhe0
Name [3R-(3-BETA,3A-ALPHA,5AR,7A-ALPHA,11A-BETA,11B-ALPHA)]-(+)-1,3,3A,6,7,7A,8,9,10,11,11A,11B-DODECAHYDRO-8,8,11A-TRIMETHYL-2H-CYCLOBUTA-[J]-PHENANTHREN-3-CARBOXY
CAS Registry Number 138644-37-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-18(2)9-4-10-19(3)15(18)8-12-20-11-7-14(20)13(17(21)22)5-6-16(19)20/h7,11,13-16H,4-6,8-10,12H2,1-3H3,(H,21,22)/t13-,14-,15+,16-,19+,20+/m1/s1
InChIKey JXXLEZKZTVNNOW-GPGBYLDCSA-N
Literature Reference Author A.ABAD,M.ARNO,A.C.CUNAT,M.L.MARIN,R.J.ZARAGOZA
Literature Reference Citation J.ORG.CHEM.,57,6861(1992)
Literature Reference DOI 10.1021/jo00051a035
Molecular Weight 302.457 g/mol
Solvent CDCl3
Source File Reference UWCS8287