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1,10-DITHIA-11,12,20,21-DIBENZO-21-CROWN-7
SpectraBase Compound ID HcryD1gYDuL
InChI InChI=1S/C22H28O5S2/c1-3-7-21-19(5-1)26-13-11-23-12-14-27-20-6-2-4-8-22(20)29-18-16-25-10-9-24-15-17-28-21/h1-8H,9-18H2
InChIKey BWEKKZWQBVYGLQ-UHFFFAOYSA-N
Mol Weight 436.58 g/mol
Molecular Formula C22H28O5S2
Exact Mass 436.137816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J9PDWNSf6wp
Name 1,10-DITHIA-11,12,20,21-DIBENZO-21-CROWN-7
Compound Number XVIII
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O5S2
InChI InChI=1S/C22H28O5S2/c1-3-7-21-19(5-1)26-13-11-23-12-14-27-20-6-2-4-8-22(20)29-18-16-25-10-9-24-15-17-28-21/h1-8H,9-18H2
InChIKey BWEKKZWQBVYGLQ-UHFFFAOYSA-N
Literature Reference Author K.V.KUDRYATSEV,V.V.SAMOFIN
Literature Reference Citation CHEM.HET.COMP.,33,106(1997)
Literature Reference DOI 10.1007/bf02290756
Molecular Weight 436.581 g/mol
Solvent CDCl3
Source File Reference UWMZ14467