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3-(4-Phenylpiperazin-1-yl)-6-(para-tolyl)pyridazine
SpectraBase Compound ID 5JMOFIjv2E4
InChI InChI=1S/C21H22N4/c1-17-7-9-18(10-8-17)20-11-12-21(23-22-20)25-15-13-24(14-16-25)19-5-3-2-4-6-19/h2-12H,13-16H2,1H3
InChIKey PWHWSYYIYGGSCJ-UHFFFAOYSA-N
Mol Weight 330.44 g/mol
Molecular Formula C21H22N4
Exact Mass 330.184447 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UD4nCXfzFt
Name 3-(4-Phenylpiperazin-1-yl)-6-(para-tolyl)pyridazine
Appearance Brown solid
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Exact Mass 330.184446724 u
Formula C21H22N4
InChI InChI=1S/C21H22N4/c1-17-7-9-18(10-8-17)20-11-12-21(23-22-20)25-15-13-24(14-16-25)19-5-3-2-4-6-19/h2-12H,13-16H2,1H3
InChIKey PWHWSYYIYGGSCJ-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI Positive ion
Literature Reference DOI 10.1021/jo3022428
Molecular Weight 330.435 g/mol
Quality 270
Reported Formula C21H22N4
SMILES C1(=CC=CC=C1)N1CCN(CC1)C=1N=NC(=CC1)C1=CC=C(C=C1)C
SPLASH splash10-0a4j-0590000000-7018c25e04024385a4c7
Source of Spectrum JOC-78-378-2u (DOI: 10.1021/jo3022428)
Wiley ID 1911662