John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=11P4MkmD1tm SpectraBase Spectrum ID=F1tKVDmg4CC

(accessed ).
(3RS,1'RS,4'RS)-SPIRO-[2H,4H-[1]-BENZOPYRAN-3,2'-BICYClO-[2.2.2]-OCT-5'-ENE]-2,4-DIONE
SpectraBase Compound ID 11P4MkmD1tm
InChI InChI=1S/C16H14O3/c17-14-12-3-1-2-4-13(12)19-15(18)16(14)9-10-5-7-11(16)8-6-10/h1-5,7,10-11H,6,8-9H2/t10-,11+,16+/m1/s1
InChIKey AUVVRFVLRXQUKL-GDLVEWKHSA-N
Mol Weight 254.28 g/mol
Molecular Formula C16H14O3
Exact Mass 254.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1tKVDmg4CC
Name (3RS,1'RS,4'RS)-SPIRO-[2H,4H-[1]-BENZOPYRAN-3,2'-BICYClO-[2.2.2]-OCT-5'-ENE]-2,4-DIONE
Compound Number 27B
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14O3
InChI InChI=1S/C16H14O3/c17-14-12-3-1-2-4-13(12)19-15(18)16(14)9-10-5-7-11(16)8-6-10/h1-5,7,10-11H,6,8-9H2/t10-,11+,16+/m1/s1
InChIKey AUVVRFVLRXQUKL-GDLVEWKHSA-N
Literature Reference Author G.APPENDINO,G.CRAVOTTO,L.TOMA,R.ANNUNZIATA,G.PALMISANO
Literature Reference Citation J.ORG.CHEM.,59,5556(1994)
Literature Reference DOI 10.1021/jo00098a013
Molecular Weight 254.285 g/mol
Solvent CDCl3
Source File Reference UWCP7442
SpectraBase Batch ID 7Ab9TCKVES2