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4-THIOMORPHOLINEACETIC ACID {p-[2-(5-NITRO-1-VINYLIMIDAZOL-2-YL)VINYL]BENZYLIDENE}HYDRAZIDE, 1,1-DIOXIDE
SpectraBase Compound ID ImDUb9pkhiz
InChI InChI=1S/C20H22N6O5S/c1-2-25-18(21-14-20(25)26(28)29)8-7-16-3-5-17(6-4-16)13-22-23-19(27)15-24-9-11-32(30,31)12-10-24/h2-8,13-14H,1,9-12,15H2,(H,23,27)/b8-7?,22-13+
InChIKey VOCQMDPFPSIALH-JXKJLDRXSA-N
Mol Weight 458.49 g/mol
Molecular Formula C20H22N6O5S
Exact Mass 458.137239 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 7O66U0Iutqb
Name 4-THIOMORPHOLINEACETIC ACID {p-[2-(5-NITRO-1-VINYLIMIDAZOL-2-YL)VINYL]BENZYLIDENE}HYDRAZIDE, 1,1-DIOXIDE
Source of Sample W. Ross & W. Jamieson, Lilly Research Centre Ltd., Windlesham, Surrey, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N6O5S
InChI InChI=1S/C20H22N6O5S/c1-2-25-18(21-14-20(25)26(28)29)8-7-16-3-5-17(6-4-16)13-22-23-19(27)15-24-9-11-32(30,31)12-10-24/h2-8,13-14H,1,9-12,15H2,(H,23,27)/b8-7?,22-13+
InChIKey VOCQMDPFPSIALH-JXKJLDRXSA-N
Literature Reference J. MED. CHEM. 18, 158(1975)
Melting Point 253-254C
Molecular Weight 458.493011
Synonyms 4-THIOMORPHOLINEACETIC ACID, /P-/2-/5-NITRO-1-VINYLIMIDAZOL-2-YL/- VINYL/BENZYLIDENE/HYDRAZIDE, 1,1-DI- OXIDE
Technique KBr WAFER