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2-((5-Phenyl-5H-thiazolo[4,3-b][1,3,4]thiadiazol-2-yl)imino)thiazolidin-4-one
SpectraBase Compound ID JUIiKPW56VA
InChI InChI=1S/C13H10N4OS3/c18-9-6-20-12(14-9)15-13-16-17-10(21-13)7-19-11(17)8-4-2-1-3-5-8/h1-5,7,11H,6H2,(H,14,15,16,18)
InChIKey NRKZGPYXMCZSPM-UHFFFAOYSA-N
Mol Weight 334.43 g/mol
Molecular Formula C13H10N4OS3
Exact Mass 334.001674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lwJZtKmfY
Name 2-((5-Phenyl-5H-thiazolo[4,3-b][1,3,4]thiadiazol-2-yl)imino)thiazolidin-4-one
Appearance Orange crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N4OS3
InChI InChI=1S/C13H10N4OS3/c18-9-6-20-12(14-9)15-13-16-17-10(21-13)7-19-11(17)8-4-2-1-3-5-8/h1-5,7,11H,6H2,(H,14,15,16,18)
InChIKey NRKZGPYXMCZSPM-UHFFFAOYSA-N
Instrument Name Kratos or Varian MAT 311 A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2826
Molecular Weight 334.430 g/mol
SMILES N1C(CSC1=NC=1SC2=CSC(c3ccccc3)N2N1)=O
SPLASH splash10-0zfr-6900000000-8b64cc232cf92c3037b2
Source of Spectrum Y-54-2364-8
Thin-Layer Chromatography Rf = 0.32 (pet. Ether (60-80)/ethyl acetate, 4:1)
Wiley ID 1878449