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3-Acetyl-5-(2-methylthioethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID H3Pl8GNAuOy
InChI InChI=1S/C14H17N3O2S/c1-10(18)13-15-12(8-9-20-2)14(19)17(16-13)11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3,(H,15,16)
InChIKey MWDHGHGWUJIGSM-UHFFFAOYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C14H17N3O2S
Exact Mass 291.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7VermXyaF
Name 3-Acetyl-5-(2-methylthioethyl)-1-phenyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3O2S
InChI InChI=1S/C14H17N3O2S/c1-10(18)13-15-12(8-9-20-2)14(19)17(16-13)11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3,(H,15,16)
InChIKey MWDHGHGWUJIGSM-UHFFFAOYSA-N
Molecular Weight 291.369 g/mol
SMILES N1C(=NN(C(C1CCSC)=O)c1ccccc1)C(=O)C
SPLASH splash10-0006-9340000000-d19b5a21a90eb51de7a6
Synonyms 3-Acetyl-5-(2-methylsulfanylethyl)-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-5-[2-(methylsulfanyl)ethyl]-1-phenyl-4,5-dihydro-1,2,4-triazin-6(1H)-one 3-Acetyl-5-[2-(methylthio)ethyl]-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one 3-Ethanoyl-5-(2-methylsulfanylethyl)-1-phenyl-2,5-dihydro-1,2,4-triazin-6-one
Wiley ID 1475547