For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Methyl N,N'-di(isoxazol-5-ylcarbonyl)-imidothiocarbamate
SpectraBase Compound ID 6TLWB95EDzP
InChI InChI=1S/C10H8N4O4S/c1-19-10(13-8(15)6-2-4-11-17-6)14-9(16)7-3-5-12-18-7/h2-5H,1H3,(H,13,14,15,16)
InChIKey PAFXUHUSYIMUFH-UHFFFAOYSA-N
Mol Weight 280.26 g/mol
Molecular Formula C10H8N4O4S
Exact Mass 280.026626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HMsaMobz6NH
Name Methyl N,N'-di(isoxazol-5-ylcarbonyl)-imidothiocarbamate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N4O4S
InChI InChI=1S/C10H8N4O4S/c1-19-10(13-8(15)6-2-4-11-17-6)14-9(16)7-3-5-12-18-7/h2-5H,1H3,(H,13,14,15,16)
InChIKey PAFXUHUSYIMUFH-UHFFFAOYSA-N
Molecular Weight 280.258 g/mol
SMILES N(\C(=N\C(c1oncc1)=O)SC)C(c1oncc1)=O
SPLASH splash10-0002-9000000000-00aee5dfb65ec86050ee
Source of Spectrum F2-46-271-5a
Synonyms N,N'-bis[5-isoxazolyl(oxo)methyl]carbamimidothioic acid methyl ester methyl N,N'-bis(1,2-oxazole-5-carbonyl)carbamimidothioate N-[N-(isoxazole-5-carbonyl)-C-methylsulfanyl-carbonimidoyl]isoxazole-5-carboxamide methyl N,N'-bis(1,2-oxazol-5-ylcarbonyl)carbamimidothioate
Wiley ID 1689910