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1,4 -bis-(6 -phenyl-1,2,4 -triazolo[3,4 -b] -1,3,4 -thiadiazol-3 -ylmethoxy)phenylene

View entire compound with spectra: 1 MS (GC)

1,4 -bis-(6 -phenyl-1,2,4 -triazolo[3,4 -b] -1,3,4 -thiadiazol-3 -ylmethoxy)phenylene
SpectraBase Compound ID 8CnoWsgI3tk
InChI InChI=1S/C26H18N8O2S2/c1-3-7-17(8-4-1)23-31-33-21(27-29-25(33)37-23)15-35-19-11-13-20(14-12-19)36-16-22-28-30-26-34(22)32-24(38-26)18-9-5-2-6-10-18/h1-14H,15-16H2
InChIKey SGSXXOUFKNGDPW-UHFFFAOYSA-N
Mol Weight 538.6 g/mol
Molecular Formula C26H18N8O2S2
Exact Mass 538.099414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLtWtqS2371
Name 1,4 -bis-(6 -phenyl-1,2,4 -triazolo[3,4 -b] -1,3,4 -thiadiazol-3 -ylmethoxy)phenylene
Alternate Name(s) 1,4-Bis-(6-phenyl-1,2,4 -triazolo[3,4-b]-1,3,4-thiadiazol-3-ylmethoxy)phenylene 1,4-Bis((6-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl)methoxy)benzene
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Formula C26H18N8O2S2
InChI InChI=1S/C26H18N8O2S2/c1-3-7-17(8-4-1)23-31-33-21(27-29-25(33)37-23)15-35-19-11-13-20(14-12-19)36-16-22-28-30-26-34(22)32-24(38-26)18-9-5-2-6-10-18/h1-14H,15-16H2
InChIKey SGSXXOUFKNGDPW-UHFFFAOYSA-N
Molecular Weight 538.604 g/mol
SMILES c12[n](N=C(S2)c2ccccc2)c(nn1)COc1ccc(OCc2[n]3c(SC(=N3)c3ccccc3)nn2)cc1
SPLASH splash10-0006-1900100000-b23dc604bf9e879ce212
Source of Spectrum EMC-37-513-4a
Wiley ID 1734705