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MIXTURE
SpectraBase Compound ID AT6vm902uuk
InChI InChI=1S/2C21H18O4/c22-21-18-17(15-9-23-19(21)25-15)16-11-5-1-3-7-13(11)20(18,10-24-21)14-8-4-2-6-12(14)16;22-10-21-13-7-3-1-5-11(13)16(12-6-2-4-8-14(12)21)17-15-9-24-20(25-15)19(23)18(17)21/h1-8,15-19,22H,9-10H2;1-8,15-18,20,22H,9-10H2/t15-,16-,17+,18+,19-,20+,21+;15?,16-,17-,18?,20?,21+/m01/s1
InChIKey YQLKSQKESPMUQD-ZKODZIHVSA-N
Mol Weight 668.74 g/mol
Molecular Formula C42H36O8
Exact Mass 668.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XLYGJNJv0Y
Name MIXTURE
Compound Number 4EA+4EB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H36O8
InChI InChI=1S/2C21H18O4/c22-21-18-17(15-9-23-19(21)25-15)16-11-5-1-3-7-13(11)20(18,10-24-21)14-8-4-2-6-12(14)16;22-10-21-13-7-3-1-5-11(13)16(12-6-2-4-8-14(12)21)17-15-9-24-20(25-15)19(23)18(17)21/h1-8,15-19,22H,9-10H2;1-8,15-18,20,22H,9-10H2/t15-,16-,17+,18+,19-,20+,21+;15?,16-,17-,18?,20?,21+/m01/s1
InChIKey YQLKSQKESPMUQD-ZKODZIHVSA-N
Literature Reference Author A.M.SAROTTI,M.M.JOULLIE,R.A.SPANEVELLO,A.G.SUAREZ
Literature Reference Citation ORG.LETTERS,8,5561(2006)
Literature Reference DOI 10.1021/ol062254g
Molecular Weight 668.743 g/mol
Sample ID 61855
Solvent CDCl3