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DL-Bis(3-chloro-9-triptycyl) ether

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DL-Bis(3-chloro-9-triptycyl) ether
SpectraBase Compound ID 65Nqxw0iLK8
InChI InChI=1S/C40H24Cl2O/c41-23-17-19-35-29(21-23)37-25-9-1-5-13-31(25)39(35,32-14-6-2-10-26(32)37)43-40-33-15-7-3-11-27(33)38(28-12-4-8-16-34(28)40)30-22-24(42)18-20-36(30)40/h1-22,37-38H/t37-,38-,39+,40+
InChIKey DBTHGVBGVXRGIC-HRGSHGMJSA-N
Mol Weight 591.5 g/mol
Molecular Formula C40H24Cl2O
Exact Mass 590.120421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PR4tnU9fkO
Name meso-Bis(3-chloro-9-triptycyl) ether
CAS Registry Number 78129-63-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C40H24Cl2O
InChI InChI=1S/C40H24Cl2O/c41-23-17-19-35-29(21-23)37-25-9-1-5-13-31(25)39(35,32-14-6-2-10-26(32)37)43-40-33-15-7-3-11-27(33)38(28-12-4-8-16-34(28)40)30-22-24(42)18-20-36(30)40/h1-22,37-38H/t37-,38-,39+,40+
InChIKey DBTHGVBGVXRGIC-HRGSHGMJSA-N
Instrument Name Jeol FX-100
Literature Reference Y. Kawada, H. Iwamura, J. Am. Chem. Soc. 105, 1449 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3