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3-Amino-5-benzylidene-2-ethylsulfanyl-imidazol-4-one
SpectraBase Compound ID cmTsoo0s1w
InChI InChI=1S/C12H13N3OS/c1-2-17-12-14-10(11(16)15(12)13)8-9-6-4-3-5-7-9/h3-8H,2,13H2,1H3
InChIKey LTLPEGSCSRSDRL-UHFFFAOYSA-N
Mol Weight 247.32 g/mol
Molecular Formula C12H13N3OS
Exact Mass 247.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I80aZcEjCcV
Name 3-Amino-5-benzylidene-2-ethylsulfanyl-imidazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3OS
InChI InChI=1S/C12H13N3OS/c1-2-17-12-14-10(11(16)15(12)13)8-9-6-4-3-5-7-9/h3-8H,2,13H2,1H3
InChIKey LTLPEGSCSRSDRL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.20069
Molecular Weight 247.316 g/mol
SMILES NN1C(=NC(=Cc2ccccc2)C1=O)SCC
SPLASH splash10-014i-0900000000-97c66975d9c7da764163
Source of Spectrum HAC-16-78-5e
Synonyms 3-Amino-5-benzylidene-2-(ethylthio)-3,5-dihydro-4H-imidazol-4-one
Wiley ID 1783488