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4-Ethyl-3-methyl-1,2,3-thiadiazol-3-ium-5-thiolate
SpectraBase Compound ID JDx8ekJsD9z
InChI InChI=1S/C5H8N2S2/c1-3-4-5(8)9-6-7(4)2/h3H2,1-2H3
InChIKey WRQCKTCXWHSNDJ-UHFFFAOYSA-N
Mol Weight 160.25 g/mol
Molecular Formula C5H8N2S2
Exact Mass 160.012891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPUKXmYDjdw
Name 4-Ethyl-3-methyl-1,2,3-thiadiazol-3-ium-5-thiolate
CAS Registry Number 56701-32-7
Comments Edited after expert review for CCl4 contamination - Original record with SpectrumID 1156400 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H8N2S2
InChI InChI=1S/C5H8N2S2/c1-3-4-5(8)9-6-7(4)2/h3H2,1-2H3
InChIKey WRQCKTCXWHSNDJ-UHFFFAOYSA-N
Molecular Weight 160.253 g/mol
SMILES CCc1c([S-])sn[n+]1C
SPLASH splash10-01ox-9100000000-84b9f9d715e4f721e493
Source of Spectrum EP-5981-0-0
Synonyms 4-Ethyl-3-methyl-5-thiadiazol-3-iumthiolate 4-Ethyl-3-methyl-thiadiazol-3-ium-5-thiolate
Wiley ID 1821472