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1,3-Propanedithiol
SpectraBase Compound ID 8adcVvWfpSl
InChI InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2
InChIKey ZJLMKPKYJBQJNH-UHFFFAOYSA-N
Mol Weight 108.22 g/mol
Molecular Formula C3H8S2
Exact Mass 108.006743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YOuw1qo11o
Name Propane <1,3-dimercapto->
Source of Sample SAFC Cat.no. W358800
CAS Registry Number 109-80-8
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 108.006742606 u
Formula C3H8S2
InChI InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2
InChIKey ZJLMKPKYJBQJNH-UHFFFAOYSA-N
Molecular Weight 108.217 g/mol
Number of Peaks 50
RI1 939
RI2 616
RI3 942
RI4 780
SMILES SCCCS
SPLASH splash10-0595-9100000000-a747f711804504abe3c3
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,3-Propanedithiol
Wiley ID LM_FFNSC3_276