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2-acetyl-4-butyl-1,4-benzothiazin-3-one
SpectraBase Compound ID KwNItBiUnZJ
InChI InChI=1S/C14H17NO2S/c1-3-4-9-15-11-7-5-6-8-12(11)18-13(10(2)16)14(15)17/h5-8,13H,3-4,9H2,1-2H3
InChIKey JVCCIGQPLUVTQK-UHFFFAOYSA-N
Mol Weight 263.35 g/mol
Molecular Formula C14H17NO2S
Exact Mass 263.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUAcpJeEbM3
Name 2-acetyl-4-butyl-1,4-benzothiazin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NO2S
InChI InChI=1S/C14H17NO2S/c1-3-4-9-15-11-7-5-6-8-12(11)18-13(10(2)16)14(15)17/h5-8,13H,3-4,9H2,1-2H3
InChIKey JVCCIGQPLUVTQK-UHFFFAOYSA-N
Molecular Weight 263.355 g/mol
SMILES C1(C(Sc2c(N1CCCC)cccc2)C(=O)C)=O
SPLASH splash10-00di-0090000000-a7be7dbc4a641a9dfea4
Source of Spectrum Y-29-1157-3
Synonyms 4-butyl-2-ethanoyl-1,4-benzothiazin-3-one
Wiley ID 1266822