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3,6,9,12-Tetraoxa-18-azabicyclo[12.3.1]octadeca-1-(18),14,16-triene-2,13-dithione
SpectraBase Compound ID 65gMBRRWbPv
InChI InChI=1S/C13H15NO4S2/c19-12-10-2-1-3-11(14-10)13(20)18-9-7-16-5-4-15-6-8-17-12/h1-3H,4-9H2
InChIKey FSTFCZLUVIXQDA-UHFFFAOYSA-N
Mol Weight 313.39 g/mol
Molecular Formula C13H15NO4S2
Exact Mass 313.04425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NLc8UziWcq
Name 3,6,9,12-Tetraoxa-18-azabicyclo[12.3.1]octadeca-1-(18),14,16-triene-2,13-dithione
CAS Registry Number 86309-67-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4S2
InChI InChI=1S/C13H15NO4S2/c19-12-10-2-1-3-11(14-10)13(20)18-9-7-16-5-4-15-6-8-17-12/h1-3H,4-9H2
InChIKey FSTFCZLUVIXQDA-UHFFFAOYSA-N
Molecular Weight 313.386 g/mol
SMILES c12nc(C(OCCOCCOCCOC2=S)=S)ccc1
SPLASH splash10-00y0-0920000000-0577c863b731a4ec2434
Source of Spectrum J-48-2637-0
Wiley ID 1314052