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DEMEPHION-S
SpectraBase Compound ID H5yzYMdw9MJ
InChI InChI=1S/C5H13O3PS2/c1-7-9(6,8-2)11-5-4-10-3/h4-5H2,1-3H3
InChIKey PSTWJANBJOHFQJ-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C5H13O3PS2
Exact Mass 216.004374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mA1eL7703G
Name DEMEPHION-S
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 216.004373622 u
Formula C5H13O3PS2
InChI InChI=1S/C5H13O3PS2/c1-7-9(6,8-2)11-5-4-10-3/h4-5H2,1-3H3
InChIKey PSTWJANBJOHFQJ-UHFFFAOYSA-N
Molecular Weight 216.250 g/mol
Nominal Mass 216 u
Number of Peaks 56
SMILES COP(=O)(OC)SCCSC
SPLASH splash10-00di-9100000000-e142a36bde6e4e78c88c
Source of Spectrum Dr. Rolf Kuehnle
Synonyms O,O-dimethyl S-[2-(methylsulfanyl)ethyl] thiophosphate
Technique GC/MS
Wiley ID WID_MSPA_3704