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DL-Bis(4-methyl-9-triptycyl) ether

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DL-Bis(4-methyl-9-triptycyl) ether
SpectraBase Compound ID 5cGp32icdLI
InChI InChI=1S/C42H30O/c1-25-13-11-23-35-37(25)39-27-15-3-7-19-31(27)41(35,32-20-8-4-16-28(32)39)43-42-33-21-9-5-17-29(33)40(30-18-6-10-22-34(30)42)38-26(2)14-12-24-36(38)42/h3-24,39-40H,1-2H3/t39-,40-,41+,42+
InChIKey CQWPWASFNOAVHA-CTHWABHMSA-N
Mol Weight 550.7 g/mol
Molecular Formula C42H30O
Exact Mass 550.229666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9l0TZ01ZfPk
Name DL-Bis(4-methyl-9-triptycyl) ether
CAS Registry Number 84065-18-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C42H30O
InChI InChI=1S/C42H30O/c1-25-13-11-23-35-37(25)39-27-15-3-7-19-31(27)41(35,32-20-8-4-16-28(32)39)43-42-33-21-9-5-17-29(33)40(30-18-6-10-22-34(30)42)38-26(2)14-12-24-36(38)42/h3-24,39-40H,1-2H3/t39-,40-,41+,42+
InChIKey CQWPWASFNOAVHA-CTHWABHMSA-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