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4,4-Dioxo-4,8,9-trithia-trans, trans-1,6,11-pentadecatriene

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4,4-Dioxo-4,8,9-trithia-trans, trans-1,6,11-pentadecatriene
SpectraBase Compound ID ILvgLVoCcmo
InChI InChI=1S/C12H20O2S3/c1-3-5-6-7-9-15-16-10-8-12-17(13,14)11-4-2/h4,6-8,10H,2-3,5,9,11-12H2,1H3/b7-6+,10-8+
InChIKey NNFBZCHEHRAPTO-LQPGMRSMSA-N
Mol Weight 292.47 g/mol
Molecular Formula C12H20O2S3
Exact Mass 292.062543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZeZdxJ8Pfj
Name 4,4-Dioxo-4,8,9-trithia-trans, trans-1,6,11-pentadecatriene
CAS Registry Number 104228-65-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O2S3
InChI InChI=1S/C12H20O2S3/c1-3-5-6-7-9-15-16-10-8-12-17(13,14)11-4-2/h4,6-8,10H,2-3,5,9,11-12H2,1H3/b7-6+,10-8+
InChIKey NNFBZCHEHRAPTO-LQPGMRSMSA-N
Instrument Name Bruker WH-90
Literature Reference E. Block, S. Ahmad, J.L. Catalfamo, J. Am. Chem. Soc. 108, 7045 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3