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3-(4,5-Dihydro-5-thioxo-1,3,4-oxadiazol-2-yl)-6-methylquinolin-4(1H)-one
SpectraBase Compound ID JOMPJxgcm2A
InChI InChI=1S/C12H9N3O2S/c1-6-2-3-9-7(4-6)10(16)8(5-13-9)11-14-15-12(18)17-11/h2-5H,1H3,(H,13,16)(H,15,18)
InChIKey LZTKMIFTJQKTRM-UHFFFAOYSA-N
Mol Weight 259.28 g/mol
Molecular Formula C12H9N3O2S
Exact Mass 259.041548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91HVJlVpMBC
Name 3-(4,5-Dihydro-5-thioxo-1,3,4-oxadiazol-2-yl)-6-methylquinolin-4(1H)-one
Alternate Name(s) 6-Methyl-3-(5-thioxo-4,5-dihydro-1,3,4-oxadiazol-2-yl)quinolin-4(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3O2S
InChI InChI=1S/C12H9N3O2S/c1-6-2-3-9-7(4-6)10(16)8(5-13-9)11-14-15-12(18)17-11/h2-5H,1H3,(H,13,16)(H,15,18)
InChIKey LZTKMIFTJQKTRM-UHFFFAOYSA-N
Molecular Weight 259.283 g/mol
SMILES N1C(OC(C2=CNc3ccc(cc3C2=O)C)=N1)=S
SPLASH splash10-002r-9420000000-d04a0ce6b468f4183ab2
Source of Spectrum Y-50-E6-12a
Wiley ID 1736489