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2,5-Dihydrothiophene 1,1-dioxide
SpectraBase Compound ID LYq1dnkvdjj
InChI InChI=1S/C4H6O2S/c5-7(6)3-1-2-4-7/h1-2H,3-4H2
InChIKey MBDNRNMVTZADMQ-UHFFFAOYSA-N
Mol Weight 118.15 g/mol
Molecular Formula C4H6O2S
Exact Mass 118.008851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10dPoh2deBe
Name 2,5-Dihydrothiophene sulfone
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 118.008850605 u
Formula C4H6O2S
GC Column DB-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C4H6O2S/c5-7(6)3-1-2-4-7/h1-2H,3-4H2
InChIKey MBDNRNMVTZADMQ-UHFFFAOYSA-N
Instrument Name Agilent series 7890B
Ionization Type EI
Literature Reference DOI 10.1021/acs.jafc.1c04415
Molecular Weight 118.150 g/mol
Quality 803
SMILES C1S(CC=C1)(=O)=O
SPLASH splash10-0udi-9000000000-1c81126f12b97f8d0b6a
Source of Spectrum JAFC-70-SM15-15-2 (DOI: 10.1021/acs.jafc.1c04415)
Wiley ID 1911496