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2-(2-Oxo-2H-chromen-3-yl)-5-cinnamoylamino-1,3,4-thiadiazole
SpectraBase Compound ID 3XxUf0tGi3J
InChI InChI=1S/C20H13N3O3S/c24-17(11-10-13-6-2-1-3-7-13)21-20-23-22-18(27-20)15-12-14-8-4-5-9-16(14)26-19(15)25/h1-12H,(H,21,23,24)
InChIKey RBICCSWMNMFPBR-UHFFFAOYSA-N
Mol Weight 375.4 g/mol
Molecular Formula C20H13N3O3S
Exact Mass 375.067762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECZ0Gl8gcby
Name 2-(2-Oxo-2H-chromen-3-yl)-5-cinnamoylamino-1,3,4-thiadiazole
Appearance Yellow crystals
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Formula C20H13N3O3S
InChI InChI=1S/C20H13N3O3S/c24-17(11-10-13-6-2-1-3-7-13)21-20-23-22-18(27-20)15-12-14-8-4-5-9-16(14)26-19(15)25/h1-12H,(H,21,23,24)
InChIKey RBICCSWMNMFPBR-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2824
Molecular Weight 375.402 g/mol
SMILES N(c1sc(C=2C(=O)Oc3c(C2)cccc3)nn1)C(C=Cc1ccccc1)=O
SPLASH splash10-0f9t-2920000000-5edca7ce459cfc9888c0
Source of Spectrum Y-54-2357-5
Wiley ID 1878436