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5-(1,3-Benzodioxol-5-ylmethylene)-2,4-thiazolidinedione
SpectraBase Compound ID CMt7AX2YGKN
InChI InChI=1S/C11H7NO4S/c13-10-7(12-11(14)17-10)3-6-1-2-8-9(4-6)16-5-15-8/h1-4H,5H2,(H,12,14)
InChIKey XGJLNMAORFVSPS-UHFFFAOYSA-N
Mol Weight 249.24 g/mol
Molecular Formula C11H7NO4S
Exact Mass 249.009579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59H3MPvKK4A
Name 5-(1,3-Benzodioxol-5-ylmethylene)-2,4-thiazolidinedione
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7NO4S
InChI InChI=1S/C11H7NO4S/c13-10-7(12-11(14)17-10)3-6-1-2-8-9(4-6)16-5-15-8/h1-4H,5H2,(H,12,14)
InChIKey XGJLNMAORFVSPS-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-GB 1000 PX
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0012.a20
Molecular Weight 249.240 g/mol
SMILES N1C(SC(C1=Cc1ccc2c(OCO2)c1)=O)=O
SPLASH splash10-004i-1910000000-c380e8611049aaa7d3d1
Source of Spectrum ARK-2011-264-8b
Wiley ID 1864326