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5-[(E)-2-(4-chlorophenyl)ethenyl]-6-methyl-4-oxidanidyl-1,2,4-triazin-4-ium
SpectraBase Compound ID 5eBTXJ4YnMb
InChI InChI=1S/C12H10ClN3O/c1-9-12(16(17)8-14-15-9)7-4-10-2-5-11(13)6-3-10/h2-8H,1H3/b7-4+
InChIKey PCSYOKLYRGWCPF-QPJJXVBHSA-N
Mol Weight 247.68 g/mol
Molecular Formula C12H10ClN3O
Exact Mass 247.05124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5QrISDfnhy
Name 5-[(E)-2-(4-chlorophenyl)ethenyl]-6-methyl-4-oxidanidyl-1,2,4-triazin-4-ium
Alternate Name(s) 5-[2-(4-Chlorophenyl)ethenyl]-6-methyl-1,2,4-triazine N4-oxide 5-[(E)-2-(4-chlorophenyl)ethenyl]-6-methyl-4-oxido-1,2,4-triazin-4-ium 5-[(E)-2-(4-chlorophenyl)vinyl]-6-methyl-4-oxido-1,2,4-triazin-4-ium (E)-5-(4-chlorostyryl)-6-methyl-1,2,4-triazine 4-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10ClN3O
InChI InChI=1S/C12H10ClN3O/c1-9-12(16(17)8-14-15-9)7-4-10-2-5-11(13)6-3-10/h2-8H,1H3/b7-4+
InChIKey PCSYOKLYRGWCPF-QPJJXVBHSA-N
Molecular Weight 247.685 g/mol
SMILES c1([n+](cnnc1C)[O-])\C=C\c1ccc(cc1)Cl
SPLASH splash10-0002-0090000000-04377c7742ce9ed45d3b
Source of Spectrum D8-337-278-7
Wiley ID 1551241