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11,22-Dimethyl-2,13-dithia-(3,3)(1,3)naphthalenophane (transoid-anti)
SpectraBase Compound ID 11ftsOD1Nqo
InChI InChI=1S/C26H24S2/c1-17-21-11-19-7-3-5-9-23(19)25(17)15-28-14-22-12-20-8-4-6-10-24(20)26(18(22)2)16-27-13-21/h3-12H,13-16H2,1-2H3
InChIKey CAQCSZHKHOCDTF-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C26H24S2
Exact Mass 400.131943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kz8Cin84Qh6
Name 11,22-Dimethyl-2,13-dithia(3,3)(1,3)naphthalenophane (transoid-syn)
CAS Registry Number 80665-03-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H24S2
InChI InChI=1S/C26H24S2/c1-17-21-11-19-7-3-5-9-23(19)25(17)15-28-14-22-12-20-8-4-6-10-24(20)26(18(22)2)16-27-13-21/h3-12H,13-16H2,1-2H3
InChIKey CAQCSZHKHOCDTF-UHFFFAOYSA-N
Instrument Name Nicolet TT-14
Literature Reference R.H. Mitchell, R.V. Williams, T.W.Dingle, J. Am. Chem. Soc. 104, 2561 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3