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1,3-Bis(6-phenyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazol-3-ylmethoxy)benzene
SpectraBase Compound ID 2sgKghGLirO
InChI InChI=1S/C28H22N8O2S2/c1-3-8-19(9-4-1)23-17-39-27-31-29-25(35(27)33-23)15-37-21-12-7-13-22(14-21)38-16-26-30-32-28-36(26)34-24(18-40-28)20-10-5-2-6-11-20/h1-14H,15-18H2
InChIKey RIIUOGGIEFZCDQ-UHFFFAOYSA-N
Mol Weight 566.66 g/mol
Molecular Formula C28H22N8O2S2
Exact Mass 566.130714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYhTUOEadT3
Name 1,3-Bis(6-phenyl-1,2,4-triazolo[3,4-b][1,3,4]thiadiazol-3-ylmethoxy)benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22N8O2S2
InChI InChI=1S/C28H22N8O2S2/c1-3-8-19(9-4-1)23-17-39-27-31-29-25(35(27)33-23)15-37-21-12-7-13-22(14-21)38-16-26-30-32-28-36(26)34-24(18-40-28)20-10-5-2-6-11-20/h1-14H,15-18H2
InChIKey RIIUOGGIEFZCDQ-UHFFFAOYSA-N
Molecular Weight 566.658 g/mol
SMILES C1(=N[n]2c(SC1)nnc2COc1cc(OCc2[n]3N=C(c4ccccc4)CSc3nn2)ccc1)c1ccccc1
SPLASH splash10-0a4r-9000000000-9f9d148530a697012d5c
Source of Spectrum Y-51-E180-11
Synonyms 1,3-Bis((6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl)methoxy)benzene
Wiley ID 1741572