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3-BUTYL-ISOINDOLIN-1-ONE
SpectraBase Compound ID 3TFXe4c25iu
InChI InChI=1S/C12H15NO/c1-2-3-8-11-9-6-4-5-7-10(9)12(14)13-11/h4-7,11H,2-3,8H2,1H3,(H,13,14)
InChIKey GMRHNUZCUUOQOX-UHFFFAOYSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7i5qJiJNJVv
Name 3-butyl-2,3-dihydroisoindol-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-2-3-8-11-9-6-4-5-7-10(9)12(14)13-11/h4-7,11H,2-3,8H2,1H3,(H,13,14)
InChIKey GMRHNUZCUUOQOX-UHFFFAOYSA-N
Molecular Weight 189.258 g/mol
SMILES N1C(c2c(C1=O)cccc2)CCCC
SPLASH splash10-001i-0900000000-b012035e17454b435163
Source of Spectrum KC-57-2586-5
Synonyms 3-butylisoindolin-1-one
Wiley ID 1623523