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(+/-)-TRANS-3'-BrOMO-4'-BENZOYLOXY-3',4'-DIHYDRO-5-METHOXYSESELIN
SpectraBase Compound ID 7xL5CLWDG3u
InChI InChI=1S/C22H19BrO6/c1-22(2)20(23)19(28-21(25)12-7-5-4-6-8-12)17-15(29-22)11-14(26-3)13-9-10-16(24)27-18(13)17/h4-11,19-20H,1-3H3/t19-,20+/m1/s1
InChIKey KAGMIZGXRMHYAN-UXHICEINSA-N
Mol Weight 459.29 g/mol
Molecular Formula C22H19BrO6
Exact Mass 458.036501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3MA5kP6RWkV
Name (+/-)-TRANS-3'-BrOMO-4'-BENZOYLOXY-3',4'-DIHYDRO-5-METHOXYSESELIN
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H19BrO6
InChI InChI=1S/C22H19BrO6/c1-22(2)20(23)19(28-21(25)12-7-5-4-6-8-12)17-15(29-22)11-14(26-3)13-9-10-16(24)27-18(13)17/h4-11,19-20H,1-3H3/t19-,20+/m1/s1
InChIKey KAGMIZGXRMHYAN-UXHICEINSA-N
Literature Reference Author E.MELLIOU,P.MAGIATIS,S.MITAKU,A.L.SKALTSOUNIS,E.CHINOU,I.CHI NOU
Literature Reference Citation J.NAT.PROD.,68,78(2005)
Literature Reference DOI 10.1021/np0497447
Molecular Weight 459.293 g/mol
Solvent CDCl3
Source File Reference UWMZ8260