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1,8-dithiacyclotetradeca-4,11-diyne

View entire compound with spectra: 1 MS (GC)

1,8-dithiacyclotetradeca-4,11-diyne
SpectraBase Compound ID C9gMvCdNirP
InChI InChI=1S/C12H16S2/c1-2-6-10-14-12-8-4-3-7-11-13-9-5-1/h5-12H2
InChIKey MNZQWFVFUTUAFJ-UHFFFAOYSA-N
Mol Weight 224.38 g/mol
Molecular Formula C12H16S2
Exact Mass 224.069343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KtA4cyernb
Name 1,8-dithiacyclotetradeca-4,11-diyne
CAS Registry Number 115465-36-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16S2
InChI InChI=1S/C12H16S2/c1-2-6-10-14-12-8-4-3-7-11-13-9-5-1/h5-12H2
InChIKey MNZQWFVFUTUAFJ-UHFFFAOYSA-N
Molecular Weight 224.380 g/mol
SMILES C1#CCCSCCC#CCCSCC1
SPLASH splash10-004i-9030000000-5d89746feff79910256c
Source of Spectrum K-121-2242-13
Wiley ID 1225070