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3-Acetyl-1-(4-iodophenyl)-5-isopropyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
SpectraBase Compound ID AM2TsHYjBMB
InChI InChI=1S/C14H16IN3O2/c1-8(2)12-14(20)18(17-13(16-12)9(3)19)11-6-4-10(15)5-7-11/h4-8,12H,1-3H3,(H,16,17)
InChIKey HSSRHCNXLISARM-UHFFFAOYSA-N
Mol Weight 385.21 g/mol
Molecular Formula C14H16IN3O2
Exact Mass 385.028722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1E1pgjAqEfa
Name 3-Acetyl-1-(4-iodophenyl)-5-isopropyl-4,5-dihydro-1H-[1,2,4]triazin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16IN3O2
InChI InChI=1S/C14H16IN3O2/c1-8(2)12-14(20)18(17-13(16-12)9(3)19)11-6-4-10(15)5-7-11/h4-8,12H,1-3H3,(H,16,17)
InChIKey HSSRHCNXLISARM-UHFFFAOYSA-N
Molecular Weight 385.205 g/mol
SMILES N1C(=NN(C(C1C(C)C)=O)c1ccc(cc1)I)C(=O)C
SPLASH splash10-000f-8129000000-ee3b8b3a0c64c8008a39
Synonyms 3-Acetyl-1-(4-iodophenyl)-5-isopropyl-2,5-dihydro-1,2,4-triazin-6-one 3-Acetyl-1-(4-iodophenyl)-5-isopropyl-4,5-dihydro-1,2,4-triazin-6(1H)-one 3-Acetyl-1-(4-iodophenyl)-5-propan-2-yl-2,5-dihydro-1,2,4-triazin-6-one 3-Ethanoyl-1-(4-iodophenyl)-5-propan-2-yl-2,5-dihydro-1,2,4-triazin-6-one
Wiley ID 1475509