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1,4-DITRITYLBENZENE
SpectraBase Compound ID FqlpYGgx9i8
InChI InChI=1S/C44H34/c1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40/h1-34H
InChIKey IWCZZOOPQBLYDZ-UHFFFAOYSA-N
Mol Weight 562.8 g/mol
Molecular Formula C44H34
Exact Mass 562.266051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6CyqEU0QRP
Name 1,4-DITRITYLBENZENE
Compound Number 2-H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H34
InChI InChI=1S/C44H34/c1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40/h1-34H
InChIKey IWCZZOOPQBLYDZ-UHFFFAOYSA-N
Literature Reference Author O.PLIETZSCH,A.SCHADE,A.HAFNER,J.HUUSKONEN,K.RISSANEN,M.NIEGE R,T.MULLER,S.BRAESE
Literature Reference Citation EUR.J.ORG.CHEM.,2013,283(2013)
Literature Reference DOI 10.1002/ejoc.201201162
Molecular Weight 562.754 g/mol
Solvent CDCl3
Source File Reference UWBT17403