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1,3,5,7-Tetra-tert-butyl-S-indacene

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1,3,5,7-Tetra-tert-butyl-S-indacene
SpectraBase Compound ID GzZEXwVvqQS
InChI InChI=1S/C28H40/c1-25(2,3)21-15-22(26(4,5)6)18-14-20-19(13-17(18)21)23(27(7,8)9)16-24(20)28(10,11)12/h13-16H,1-12H3
InChIKey XSHFMLKAINYIBV-UHFFFAOYSA-N
Mol Weight 376.6 g/mol
Molecular Formula C28H40
Exact Mass 376.313001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 18Ebf1gXySe
Name 1,3,5,7-Tetra-tert-butyl-S-indacene
CAS Registry Number 101998-70-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H40
InChI InChI=1S/C28H40/c1-25(2,3)21-15-22(26(4,5)6)18-14-20-19(13-17(18)21)23(27(7,8)9)16-24(20)28(10,11)12/h13-16H,1-12H3
InChIKey XSHFMLKAINYIBV-UHFFFAOYSA-N
Instrument Name Bruker AM-300
Literature Reference K. Hafner, B. Stowasser, H.P. Krimmer, Angew. Chem. 98, 646 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3