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1,2-Bis{2-(3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-6-yl)phenoxy}ethane
SpectraBase Compound ID KyrPvQ8w5Ff
InChI InChI=1S/C34H26N8O2S2/c1-3-11-23(12-4-1)31-35-37-33-41(31)39-27(21-45-33)25-15-7-9-17-29(25)43-19-20-44-30-18-10-8-16-26(30)28-22-46-34-38-36-32(42(34)40-28)24-13-5-2-6-14-24/h1-18H,19-22H2
InChIKey ISTSLKCCHJAXOH-UHFFFAOYSA-N
Mol Weight 642.8 g/mol
Molecular Formula C34H26N8O2S2
Exact Mass 642.162014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eZvwRGbdTT
Name 1,2-Bis{2-(3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-6-yl)phenoxy}ethane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H26N8O2S2
InChI InChI=1S/C34H26N8O2S2/c1-3-11-23(12-4-1)31-35-37-33-41(31)39-27(21-45-33)25-15-7-9-17-29(25)43-19-20-44-30-18-10-8-16-26(30)28-22-46-34-38-36-32(42(34)40-28)24-13-5-2-6-14-24/h1-18H,19-22H2
InChIKey ISTSLKCCHJAXOH-UHFFFAOYSA-N
Molecular Weight 642.756 g/mol
SMILES C(COc1c(cccc1)C1=N[n]2c(SC1)nnc2-c1ccccc1)Oc1c(cccc1)C1=N[n]2c(SC1)nnc2-c1ccccc1
SPLASH splash10-004i-6900100000-4c2abd75c2676daa58fd
Source of Spectrum Y-49-643-10a
Wiley ID 1716704