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1-Allyl-4-methoxycarbonylmethylene-perhydro-5-oxo-2-thioxoimidazole
SpectraBase Compound ID 4ORcMIe2Esb
InChI InChI=1S/C9H10N2O3S/c1-3-4-11-8(13)6(10-9(11)15)5-7(12)14-2/h3,5H,1,4H2,2H3,(H,10,15)/b6-5-
InChIKey CTAKRPXTNOUMRV-WAYWQWQTSA-N
Mol Weight 226.25 g/mol
Molecular Formula C9H10N2O3S
Exact Mass 226.041213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2WHgvlnuv1
Name 1-Allyl-4-methoxycarbonylmethylene-perhydro-5-oxo-2-thioxoimidazole
Alternate Name(s) Methyl (2Z)-(1-allyl-5-oxo-2-thioxo-4-imidazolidinylidene)ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10N2O3S
InChI InChI=1S/C9H10N2O3S/c1-3-4-11-8(13)6(10-9(11)15)5-7(12)14-2/h3,5H,1,4H2,2H3,(H,10,15)/b6-5-
InChIKey CTAKRPXTNOUMRV-WAYWQWQTSA-N
Molecular Weight 226.250 g/mol
SMILES N1\C(C(N(C1=S)CC=C)=O)=C/C(=O)OC
SPLASH splash10-014l-9420000000-cebaea4162720630eb1c
Source of Spectrum HC-23-976-0
Wiley ID 1226817