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(3E,8R,11E,16R)-8,16-Dimethyl-1,19-dioxa-5,5,13,13-bis(trimethylene-dithio)-cyclohexadeca-3,11-diene-2,10-dione

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(3E,8R,11E,16R)-8,16-Dimethyl-1,19-dioxa-5,5,13,13-bis(trimethylene-dithio)-cyclohexadeca-3,11-diene-2,10-dione
SpectraBase Compound ID 67jFZz9R4Fd
InChI InChI=1S/C22H32O4S4/c1-17-5-9-21(27-13-3-14-28-21)12-8-20(24)26-18(2)6-10-22(11-7-19(23)25-17)29-15-4-16-30-22/h7-8,11-12,17-18H,3-6,9-10,13-16H2,1-2H3/b11-7+,12-8+
InChIKey ZDBHXOKBXFBJCW-MKICQXMISA-N
Mol Weight 488.7 g/mol
Molecular Formula C22H32O4S4
Exact Mass 488.118344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lEeSPmNo0e
Name (3E,8R,11E,16R)-8,16-Dimethyl-1,19-dioxa-5,5,13,13-bis(trimethylene-dithio)-cyclohexadeca-3,11-diene-2,10-dione
CAS Registry Number 61989-64-8
Comments *7R,14R
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H32O4S4
InChI InChI=1S/C22H32O4S4/c1-17-5-9-21(27-13-3-14-28-21)12-8-20(24)26-18(2)6-10-22(11-7-19(23)25-17)29-15-4-16-30-22/h7-8,11-12,17-18H,3-6,9-10,13-16H2,1-2H3/b11-7+,12-8+
InChIKey ZDBHXOKBXFBJCW-MKICQXMISA-N
Literature Reference B. Seuring, D. Seebach, Liebigs Ann. Chem. 2044 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3