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2-[2-[[5-[2-(2-Aminoethoxy)ethylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanyl]ethoxy]ethanamine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-[2-[[5-[2-(2-Aminoethoxy)ethylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanyl]ethoxy]ethanamine
SpectraBase Compound ID GjXiU3hVBt5
InChI InChI=1S/C16H26N2O2S8/c1-21-11-12(22-2)26-15(25-11)16-27-13(23-9-7-19-5-3-17)14(28-16)24-10-8-20-6-4-18/h3-10,17-18H2,1-2H3
InChIKey NNQLYUZGLYUNOM-UHFFFAOYSA-N
Mol Weight 534.9 g/mol
Molecular Formula C16H26N2O2S8
Exact Mass 533.975997 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9DI1MXCfeBL
Name 2-[2-[[5-[2-(2-Aminoethoxy)ethylsulfanyl]-2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiol-4-yl]sulfanyl]ethoxy]ethanamine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 533.975997475 u
Formula C16H26N2O2S8
InChI InChI=1S/C16H26N2O2S8/c1-21-11-12(22-2)26-15(25-11)16-27-13(23-9-7-19-5-3-17)14(28-16)24-10-8-20-6-4-18/h3-10,17-18H2,1-2H3
InChIKey NNQLYUZGLYUNOM-UHFFFAOYSA-N
Molecular Weight 534.876 g/mol
SMILES C1(=C2SC(SC)=C(S2)SC)SC(SCCOCCN)=C(S1)SCCOCCN