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3-Acetyl-1-(4-chlorophenyl)-5-methyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID 3SKXoJ61RQX
InChI InChI=1S/C12H12ClN3O2/c1-7-12(18)16(15-11(14-7)8(2)17)10-5-3-9(13)4-6-10/h3-7H,1-2H3,(H,14,15)
InChIKey JETDMQTVHGJLFC-UHFFFAOYSA-N
Mol Weight 265.7 g/mol
Molecular Formula C12H12ClN3O2
Exact Mass 265.061804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2BEnUStXFZ
Name 3-Acetyl-1-(4-chlorophenyl)-5-methyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
CAS Registry Number 139455-72-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClN3O2
InChI InChI=1S/C12H12ClN3O2/c1-7-12(18)16(15-11(14-7)8(2)17)10-5-3-9(13)4-6-10/h3-7H,1-2H3,(H,14,15)
InChIKey JETDMQTVHGJLFC-UHFFFAOYSA-N
Molecular Weight 265.700 g/mol
SMILES N1C(=NN(C(C1C)=O)c1ccc(cc1)Cl)C(=O)C
SPLASH splash10-006x-9350000000-c6740d5e4ba8713e8d40
Synonyms 1-(4-Chlorophenyl)-3-ethanoyl-5-methyl-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(4-chlorophenyl)-5-methyl-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(4-chlorophenyl)-5-methyl-4,5-dihydro-1,2,4-triazin-6(1H)-one
Wiley ID 1475557