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3-Amino-5-benzylidene-2-methylsulfanyl-imidazol-4-one
SpectraBase Compound ID 9H7RUrW5uCi
InChI InChI=1S/C11H11N3OS/c1-16-11-13-9(10(15)14(11)12)7-8-5-3-2-4-6-8/h2-7H,12H2,1H3
InChIKey NBXHAVDVVQXMHT-UHFFFAOYSA-N
Mol Weight 233.29 g/mol
Molecular Formula C11H11N3OS
Exact Mass 233.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnBhPiCnVBL
Name 3-Amino-5-benzylidene-2-methylsulfanyl-imidazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3OS
InChI InChI=1S/C11H11N3OS/c1-16-11-13-9(10(15)14(11)12)7-8-5-3-2-4-6-8/h2-7H,12H2,1H3
InChIKey NBXHAVDVVQXMHT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.20069
Molecular Weight 233.289 g/mol
SMILES NN1C(=NC(=Cc2ccccc2)C1=O)SC
SPLASH splash10-00li-8590000000-55cc3648f6fb78484b20
Source of Spectrum HAC-16-78-5a
Synonyms 3-Amino-5-benzylidene-2-(methylthio)-3,5-dihydro-4H-imidazol-4-one
Wiley ID 1783484