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2,11-Dithia-5,8-dioxabicyclo[10.4.1]heptadeca-1(16),12,14-trien-17-one
SpectraBase Compound ID 6UeOGhD1BIo
InChI InChI=1S/C13H16O3S2/c14-13-11-3-1-2-4-12(13)18-10-8-16-6-5-15-7-9-17-11/h1-4H,5-10H2
InChIKey DLRXPUWMQFIBBK-UHFFFAOYSA-N
Mol Weight 284.39 g/mol
Molecular Formula C13H16O3S2
Exact Mass 284.054087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yhko3KMtdn
Name 2,11-Dithia-5,8-dioxabicyclo[10.4.1]heptadeca-1(16),12,14-trien-17-one
Alternate Name(s) 2,11-Dithia-5,8-dioxabicyclo[10.4.1]heptadecan-17-one 5,8-Dioxa-2,11-dithiabicyclo[10.4.1]heptadeca-1(16),12,14-trien-17-one
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Formula C13H16O3S2
InChI InChI=1S/C13H16O3S2/c14-13-11-3-1-2-4-12(13)18-10-8-16-6-5-15-7-9-17-11/h1-4H,5-10H2
InChIKey DLRXPUWMQFIBBK-UHFFFAOYSA-N
Molecular Weight 284.388 g/mol
SMILES C1(C=2SCCOCCOCCSC1=CC=CC2)=O
SPLASH splash10-01qa-1940000000-f5e92c77474f9557ec68
Source of Spectrum AJ-66-3453-3
Wiley ID 772420