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4,7-Bis(4-methoxyphenyl)[1,2,5]thiadiazolo[3,4-d]pyridazine
SpectraBase Compound ID 7PCbKrH84a0
InChI InChI=1S/C18H14N4O2S/c1-23-13-7-3-11(4-8-13)15-17-18(22-25-21-17)16(20-19-15)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3
InChIKey JCJGCQHRXWAIKC-UHFFFAOYSA-N
Mol Weight 350.4 g/mol
Molecular Formula C18H14N4O2S
Exact Mass 350.083747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRLbeoewn9O
Name 4,7-Bis(4-methoxyphenyl)[1,2,5]thiadiazolo[3,4-d]pyridazine
Appearance Orange solid
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Exact Mass 350.083746879 u
Formula C18H14N4O2S
InChI InChI=1S/C18H14N4O2S/c1-23-13-7-3-11(4-8-13)15-17-18(22-25-21-17)16(20-19-15)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3
InChIKey JCJGCQHRXWAIKC-UHFFFAOYSA-N
Instrument Name Finnigan MAT INCOS 50
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800961
Molecular Weight 350.396 g/mol
Quality 94
Reported Formula C18H14N4O2S
SMILES COC1=CC=C(C=C1)C1=NN=C(C=2C1=NSN2)C1=CC=C(OC)C=C1
SPLASH splash10-0udi-2309000000-2b7e4fe8ea464802c160
Source of Spectrum K1-2018-5676-7i (DOI: 10.1002/ejoc.201800961)
Thin-Layer Chromatography 0.1 (CH2Cl2)
Wiley ID 1894391