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6-BROMOBENZ-[A]-INDENO-[1,2,3-CD]-AZULENE
SpectraBase Compound ID 3ugUuVSaec9
InChI InChI=1S/C20H11Br/c21-12-9-10-17-18(11-12)16-8-4-3-7-14-13-5-1-2-6-15(13)20(17)19(14)16/h1-11H
InChIKey DETQTRZSSMTVAX-UHFFFAOYSA-N
Mol Weight 331.21 g/mol
Molecular Formula C20H11Br
Exact Mass 330.004413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F1JyzhWwiLH
Name 6-BROMOBENZ-[A]-INDENO-[1,2,3-CD]-AZULENE
CAS Registry Number 124581-63-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H11Br
InChI InChI=1S/C20H11Br/c21-12-9-10-17-18(11-12)16-8-4-3-7-14-13-5-1-2-6-15(13)20(17)19(14)16/h1-11H
InChIKey DETQTRZSSMTVAX-UHFFFAOYSA-N
Literature Reference Author T.TODA,M.MINABE,M.YOSHIDA,K.TOBITA
Literature Reference Citation J.ORG.CHEM.,55,1297(1990)
Literature Reference DOI 10.1021/jo00291a037
Molecular Weight 331.211 g/mol
Solvent CDCl3
Source File Reference UWED13940