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6-methyl-4-[(N-methylanilino)methyl]-1-benzothiopyran-2-one
SpectraBase Compound ID FJPQciHoR7A
InChI InChI=1S/C18H17NOS/c1-13-8-9-17-16(10-13)14(11-18(20)21-17)12-19(2)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
InChIKey NVXXWPBDJFCKCV-UHFFFAOYSA-N
Mol Weight 295.4 g/mol
Molecular Formula C18H17NOS
Exact Mass 295.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BH1YLdWQ6uy
Name 6-methyl-4-[(N-methylanilino)methyl]-1-benzothiopyran-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H17NOS
InChI InChI=1S/C18H17NOS/c1-13-8-9-17-16(10-13)14(11-18(20)21-17)12-19(2)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
InChIKey NVXXWPBDJFCKCV-UHFFFAOYSA-N
Molecular Weight 295.400 g/mol
SMILES C=1(c2c(ccc(c2)C)SC(C1)=O)CN(c1ccccc1)C
SPLASH splash10-00kb-0090000000-7f4bc889ee47ecd0f74b
Source of Spectrum Y-29-137-5
Synonyms 6-methyl-4-[(N-methylanilino)methyl]thiochromen-2-one 6-methyl-4-[[methyl(phenyl)amino]methyl]thiochromen-2-one
Wiley ID 1298280