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4-Isothiazolecarboxamide, 3,5-bis(methylthio)-
SpectraBase Compound ID KLfpgqpfFbs
InChI InChI=1S/C6H8N2OS3/c1-10-5-3(4(7)9)6(11-2)12-8-5/h1-2H3,(H2,7,9)
InChIKey BCSXDEAYNLDINS-UHFFFAOYSA-N
Mol Weight 220.32 g/mol
Molecular Formula C6H8N2OS3
Exact Mass 219.979876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xZrZy3GGys
Name 4-Isothiazolecarboxamide, 3,5-bis(methylthio)-
CAS Registry Number 4886-14-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8N2OS3
InChI InChI=1S/C6H8N2OS3/c1-10-5-3(4(7)9)6(11-2)12-8-5/h1-2H3,(H2,7,9)
InChIKey BCSXDEAYNLDINS-UHFFFAOYSA-N
Molecular Weight 220.323 g/mol
SMILES NC(=O)c1c(SC)nsc1SC
SPLASH splash10-0zmj-9450000000-c4a48ace3f3c8d9f7734
Source of Spectrum EP-6428-0-0
Synonyms 3,5-Bis(methylsulfanyl)-4-isothiazolecarboxamide 3,5-bis(methylsulfanyl)-1,2-thiazole-4-carboxamide 3,5-bis(methylsulfanyl)isothiazole-4-carboxamide 3,5-bis(methylthio)-4-isothiazolecarboxamide 3,5-bis(methylthio)isothiazole-4-carboxamide
Wiley ID 1219196