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(Z)-5-(2-((1-(3,4-Dichlorobenzyl)-1H-1,2,3-triazol-4-yl)methoxy)benzylidene)-2-(phenylamino)thiazol-4(5H)-one
SpectraBase Compound ID Im5YO9lAPoI
InChI InChI=1S/C26H19Cl2N5O2S/c27-21-11-10-17(12-22(21)28)14-33-15-20(31-32-33)16-35-23-9-5-4-6-18(23)13-24-25(34)30-26(36-24)29-19-7-2-1-3-8-19/h1-13,15H,14,16H2,(H,29,30,34)/b24-13-
InChIKey HGCCTLVTYXZAAV-CFRMEGHHSA-N
Mol Weight 536.44 g/mol
Molecular Formula C26H19Cl2N5O2S
Exact Mass 535.063651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HbLnOmfMcP2
Name (Z)-5-(2-((1-(3,4-Dichlorobenzyl)-1H-1,2,3-triazol-4-yl)methoxy)benzylidene)-2-(phenylamino)thiazol-4(5H)-one
Appearance Brown solid
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Formula C26H19Cl2N5O2S
InChI InChI=1S/C26H19Cl2N5O2S/c27-21-11-10-17(12-22(21)28)14-33-15-20(31-32-33)16-35-23-9-5-4-6-18(23)13-24-25(34)30-26(36-24)29-19-7-2-1-3-8-19/h1-13,15H,14,16H2,(H,29,30,34)/b24-13-
InChIKey HGCCTLVTYXZAAV-CFRMEGHHSA-N
Instrument Name Finnigan-Mat 8430
Ionization Type EI
Literature Reference DOI 10.1002/aoc.5962
Molecular Weight 536.437 g/mol
SMILES N(C1=NC(\C(=C\c2ccccc2OCc2nn[n](c2)Cc2ccc(c(c2)Cl)Cl)S1)=O)c1ccccc1
SPLASH splash10-022a-9510000000-80fd53e4267974504195
Source of Spectrum AOC-34-SM24-9b
Wiley ID 1855740