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(1S*,6S*,12S*)-6-Methyl-1,12-(tetramethylene)-5,8-dithia-2,11-dioxacyclododecan-3,10-dione
SpectraBase Compound ID Gi8zoYO4DJZ
InChI InChI=1S/C13H20O4S2/c1-9-6-18-7-12(14)16-10-4-2-3-5-11(10)17-13(15)8-19-9/h9-11H,2-8H2,1H3/t9-,10-,11-/m0/s1
InChIKey VNGRAIPPMIUKRS-DCAQKATOSA-N
Mol Weight 304.42 g/mol
Molecular Formula C13H20O4S2
Exact Mass 304.080301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3VfdUr4LKd
Name (1S*,6S*,12S*)-6-Methyl-1,12-(tetramethylene)-5,8-dithia-2,11-dioxacyclododecan-3,10-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4S2
InChI InChI=1S/C13H20O4S2/c1-9-6-18-7-12(14)16-10-4-2-3-5-11(10)17-13(15)8-19-9/h9-11H,2-8H2,1H3/t9-,10-,11-/m0/s1
InChIKey VNGRAIPPMIUKRS-DCAQKATOSA-N
Molecular Weight 304.419 g/mol
SMILES C1(O[C@@]2([C@@](OC(CSC[C@@](SC1)(C)[H])=O)(CCCC2)[H])[H])=O
SPLASH splash10-0ff0-4903000000-89b4eed35388c5f1693e
Source of Spectrum F-51-11438-5
Synonyms (1S*,6S*,12S*)-6-Methyl-1,12-(tetramethylene)-5,8-dithio-2,11-dioxacyclododecan-3,10-dione (5S,10aS,14aS)-5-methyloctahydro-1,10,4,7-benzodioxadithiacyclododecin-2,9(3H,8H)-dione
Wiley ID 793792