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2-Methyl-3-oxidanylidene-N-phenyl-piperazine-2-carbothioamide
SpectraBase Compound ID KpE6j0ifpAQ
InChI InChI=1S/C12H15N3OS/c1-12(10(16)13-7-8-14-12)11(17)15-9-5-3-2-4-6-9/h2-6,14H,7-8H2,1H3,(H,13,16)(H,15,17)
InChIKey KIZLGINAXKOJCM-UHFFFAOYSA-N
Mol Weight 249.33 g/mol
Molecular Formula C12H15N3OS
Exact Mass 249.093583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHlKzT15SON
Name 2-Methyl-3-oxidanylidene-N-phenyl-piperazine-2-carbothioamide
Alternate Name(s) 2-Methyl-3-oxo-N-phenyl-2-piperazinecarbothioamide 2-Methyl-3-oxo-N-phenyl-piperazine-2-carbothioamide 3-keto-2-methyl-N-phenyl-piperazine-2-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N3OS
InChI InChI=1S/C12H15N3OS/c1-12(10(16)13-7-8-14-12)11(17)15-9-5-3-2-4-6-9/h2-6,14H,7-8H2,1H3,(H,13,16)(H,15,17)
InChIKey KIZLGINAXKOJCM-UHFFFAOYSA-N
Molecular Weight 249.332 g/mol
SMILES N(C(C1(C(NCCN1)=O)C)=S)c1ccccc1
SPLASH splash10-01p9-3900000000-de3f751466f481c46e85
Source of Spectrum F-68-2336-5
Wiley ID 1572047