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3-(2-Chloro-6-fluoro-phenyl)-6-(4-piperonylpiperazino)-[1,2,4]triazolo[4,3-b]pyridazine
SpectraBase Compound ID FOgBDPUBKEJ
InChI InChI=1S/C23H20ClFN6O2/c24-16-2-1-3-17(25)22(16)23-27-26-20-6-7-21(28-31(20)23)30-10-8-29(9-11-30)13-15-4-5-18-19(12-15)33-14-32-18/h1-7,12H,8-11,13-14H2
InChIKey CSEGZRSRGATAQS-UHFFFAOYSA-N
Mol Weight 466.9 g/mol
Molecular Formula C23H20ClFN6O2
Exact Mass 466.13203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOD5mnEm3AT
Name 3-(2-Chloro-6-fluoro-phenyl)-6-(4-piperonylpiperazino)-[1,2,4]triazolo[4,3-b]pyridazine
Alternate Name(s) 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(2-chloranyl-6-fluoranyl-phenyl)-[1,2,4]triazolo[4,3-b]pyridazine 6-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(2-chloro-6-fluoro-phenyl)-[1,2,4]triazolo[4,3-b]pyridazine 6-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-(2-chloro-6-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazine
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Formula C23H20ClFN6O2
InChI InChI=1S/C23H20ClFN6O2/c24-16-2-1-3-17(25)22(16)23-27-26-20-6-7-21(28-31(20)23)30-10-8-29(9-11-30)13-15-4-5-18-19(12-15)33-14-32-18/h1-7,12H,8-11,13-14H2
InChIKey CSEGZRSRGATAQS-UHFFFAOYSA-N
Molecular Weight 466.904 g/mol
SMILES c12[n](N=C(C=C2)N2CCN(CC2)Cc2cc3c(cc2)OCO3)c(nn1)-c1c(cccc1F)Cl
SPLASH splash10-000i-9810000000-599bc9020c7541d7cb15
Wiley ID 1512248