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2,2'-((4-Methoxyphenoxy)methylene)bis(1,3-benzothiazole)
SpectraBase Compound ID LrHU0US9C33
InChI InChI=1S/C22H16N2O2S2/c1-25-14-10-12-15(13-11-14)26-20(21-23-16-6-2-4-8-18(16)27-21)22-24-17-7-3-5-9-19(17)28-22/h2-13,20H,1H3
InChIKey XRYXGGFANJVSAM-UHFFFAOYSA-N
Mol Weight 404.5 g/mol
Molecular Formula C22H16N2O2S2
Exact Mass 404.06532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E5V85EgC71K
Name 2,2'-((4-methoxyphenoxy)methylene)bis(1,3-benzothiazole)
Comments Computed using HOSE algorithm
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Exact Mass 404.065320109 u
Formula C22H16N2O2S2
InChI InChI=1S/C22H16N2O2S2/c1-25-14-10-12-15(13-11-14)26-20(21-23-16-6-2-4-8-18(16)27-21)22-24-17-7-3-5-9-19(17)28-22/h2-13,20H,1H3
InChIKey XRYXGGFANJVSAM-UHFFFAOYSA-N
Molecular Weight 404.502 g/mol
SMILES C1(C(C2=NC3=CC=CC=C3S2)OC=2C=CC(=CC2)OC)=NC2=CC=CC=C2S1