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3-Acetyl-1-(4-chlorophenyl)-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID BeVizNpGgXk
InChI InChI=1S/C11H10ClN3O2/c1-7(16)11-13-6-10(17)15(14-11)9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,13,14)
InChIKey DXMUBAMEJRXTTD-UHFFFAOYSA-N
Mol Weight 251.67 g/mol
Molecular Formula C11H10ClN3O2
Exact Mass 251.046154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FJQQssYlD85
Name 3-Acetyl-1-(4-chlorophenyl)-4,5-dihydro-1H-[1,2,4]triazin-6-one
CAS Registry Number 139455-67-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClN3O2
InChI InChI=1S/C11H10ClN3O2/c1-7(16)11-13-6-10(17)15(14-11)9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,13,14)
InChIKey DXMUBAMEJRXTTD-UHFFFAOYSA-N
Molecular Weight 251.673 g/mol
SMILES N1C(=NN(C(C1)=O)c1ccc(cc1)Cl)C(=O)C
SPLASH splash10-0006-9330000000-b3e22dc06d7dea1ad7b9
Synonyms 1-(4-Chlorophenyl)-3-ethanoyl-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(4-chlorophenyl)-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(4-chlorophenyl)-4,5-dihydro-1,2,4-triazin-6(1H)-one
Wiley ID 1475730