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[2AR-(2A-ALPHA,4A-BETA,11A-BETA,11Br(*))]-3,3,4A,8,11A-PENTAMETHYL-5-METHYLENE-1,2,2A,3,4,4A,9,10,11,11A-DECAHYDRO-7-OXAINDENO-[1,7-CD]-AZULEN-6(5H)-ONE
SpectraBase Compound ID KKKPPi2AfMH
InChI InChI=1S/C21H30O2/c1-13-8-7-10-19(5)11-9-15-18(3,4)12-20(6)14(2)17(22)23-16(13)21(15,19)20/h15H,2,7-12H2,1,3-6H3/t15-,19+,20+,21?/m1/s1
InChIKey OJVICPFPMLZXCF-ZOTVYZACSA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VIUnSMV20j
Name [2AR-(2A-ALPHA,4A-BETA,11A-BETA,11Br(*))]-3,3,4A,8,11A-PENTAMETHYL-5-METHYLENE-1,2,2A,3,4,4A,9,10,11,11A-DECAHYDRO-7-OXAINDENO-[1,7-CD]-AZULEN-6(5H)-ONE
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-13-8-7-10-19(5)11-9-15-18(3,4)12-20(6)14(2)17(22)23-16(13)21(15,19)20/h15H,2,7-12H2,1,3-6H3/t15-,19+,20+,21?/m1/s1
InChIKey OJVICPFPMLZXCF-ZOTVYZACSA-N
Literature Reference Author A.F.O.CHIN,L.R.HANTON,R.T.WEAVERS
Literature Reference Citation AUSTR.J.CHEM.,50,279(1997)
Literature Reference DOI 10.1071/C96104
Molecular Weight 314.468 g/mol
Solvent CDCl3
Source File Reference UWCS15868