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2-Methyl-7-methylamino-6-methylsulfanyl-2H-isoquinoline-3,5,8-trione
SpectraBase Compound ID D8QLDgPF9Fx
InChI InChI=1S/C12H12N2O3S/c1-13-9-10(16)7-5-14(2)8(15)4-6(7)11(17)12(9)18-3/h4-5,13H,1-3H3
InChIKey FDTWIWVNHOQCJQ-UHFFFAOYSA-N
Mol Weight 264.3 g/mol
Molecular Formula C12H12N2O3S
Exact Mass 264.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lfan9n4MMmC
Name 2-Methyl-7-methylamino-6-methylsulfanyl-2H-isoquinoline-3,5,8-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O3S
InChI InChI=1S/C12H12N2O3S/c1-13-9-10(16)7-5-14(2)8(15)4-6(7)11(17)12(9)18-3/h4-5,13H,1-3H3
InChIKey FDTWIWVNHOQCJQ-UHFFFAOYSA-N
Molecular Weight 264.299 g/mol
SMILES N(C=1C(C=2C(C(C1SC)=O)=CC(=O)N(C2)C)=O)C
SPLASH splash10-03dj-0090000000-165dfb7a2a2a367ca733
Source of Spectrum F-59-1355-15
Wiley ID 1677101