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S-ethyl 3-(ethylthio)propanethioate
SpectraBase Compound ID 1sVff0XSHRU
InChI InChI=1S/C7H14OS2/c1-3-9-6-5-7(8)10-4-2/h3-6H2,1-2H3
InChIKey JEHZUHNPBVBDKE-UHFFFAOYSA-N
Mol Weight 178.31 g/mol
Molecular Formula C7H14OS2
Exact Mass 178.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EELODbhayME
Name S-ethyl 3-(ethylthio)propanethioate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.048607418 u
Formula C7H14OS2
GC Column Agilent 190915-433UI (30 m x 250 microm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 320oC
InChI InChI=1S/C7H14OS2/c1-3-9-6-5-7(8)10-4-2/h3-6H2,1-2H3
InChIKey JEHZUHNPBVBDKE-UHFFFAOYSA-N
Instrument Name Agilent 8890-5977B
Ionization Type EI
Literature Reference DOI 10.1002/chem.202202212
Molecular Weight 178.308 g/mol
Quality 247
SMILES C(C)SC(CCSCC)=O
SPLASH splash10-004r-9300000000-0834fbdc0df509d15487
Source of Spectrum QE-28-SM15-1d (DOI: 10.1002/chem.202202212)
Thin-Layer Chromatography 0.08 (nHex)
Wiley ID 1902352