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2-(1-CYCLOPENTEN-1-YL)-2-HEPTYL-m-DITHIANE
SpectraBase Compound ID 6Rgr6AmmIT8
InChI InChI=1S/C16H28S2/c1-2-3-4-5-8-12-16(15-10-6-7-11-15)17-13-9-14-18-16/h10H,2-9,11-14H2,1H3
InChIKey PTDLMLYFODUECR-UHFFFAOYSA-N
Mol Weight 284.52 g/mol
Molecular Formula C16H28S2
Exact Mass 284.163243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbYQmvYpll5
Name 2-(1-Cyclopentenyl)-2-heptyl-1,3-dithiane
CAS Registry Number 54561-54-5
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H28S2
InChI InChI=1S/C16H28S2/c1-2-3-4-5-8-12-16(15-10-6-7-11-15)17-13-9-14-18-16/h10H,2-9,11-14H2,1H3
InChIKey PTDLMLYFODUECR-UHFFFAOYSA-N
Literature Reference D. Seebach, M. Kolb, Liebigs Ann. Chem. 811 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3