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3-Methyl-2,3-dihydroisoindol-1-one
SpectraBase Compound ID he3noIiC6p
InChI InChI=1S/C9H9NO/c1-6-7-4-2-3-5-8(7)9(11)10-6/h2-6H,1H3,(H,10,11)/t6-/m1/s1
InChIKey VNPWIDIVQOFLQS-ZCFIWIBFSA-N
Mol Weight 147.18 g/mol
Molecular Formula C9H9NO
Exact Mass 147.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lm8C1o4rMw2
Name 3-methyl-2,3-dihydroisoindol-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C9H9NO
InChI InChI=1S/C9H9NO/c1-6-7-4-2-3-5-8(7)9(11)10-6/h2-6H,1H3,(H,10,11)/t6-/m1/s1
InChIKey VNPWIDIVQOFLQS-ZCFIWIBFSA-N
Molecular Weight 147.177 g/mol
SMILES N1[C@@](c2c(C1=O)cccc2)(C)[H]
SPLASH splash10-001j-0900000000-d2465baf5d25ca334e95
Source of Spectrum KC-57-2586-5
Synonyms 3-methylisoindolin-1-one (3R)-3-methyl-2,3-dihydroisoindol-1-one
Wiley ID 1623526