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(2S)-2-(1,3-dihydro-2H-isoindol-2-yl)-4-methylpentanoic acid
SpectraBase Compound ID 1KQLJsl4keV
InChI InChI=1S/C14H19NO2/c1-10(2)7-13(14(16)17)15-8-11-5-3-4-6-12(11)9-15/h3-6,10,13H,7-9H2,1-2H3,(H,16,17)/t13-/m0/s1
InChIKey URIFNSVWWFPORM-ZDUSSCGKSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOTNHJNDOg8
Name (2S)-2-(1,3-dihydro-2H-isoindol-2-yl)-4-methylpentanoic acid
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Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-10(2)7-13(14(16)17)15-8-11-5-3-4-6-12(11)9-15/h3-6,10,13H,7-9H2,1-2H3,(H,16,17)/t13-/m0/s1
InChIKey URIFNSVWWFPORM-ZDUSSCGKSA-N
Molecular Weight 233.311 g/mol
SMILES OC([C@@](N1Cc2ccccc2C1)(CC(C)C)[H])=O
SPLASH splash10-000i-0900000000-dc9b7e8cd89af491fda9
Source of Spectrum OP-33-347-4
Synonyms (2S)-2-(1,3-dihydroisoindol-2-yl)-4-methyl-pentanoic acid (2S)-2-(2,3-dihydro-1H-isoindol-2-ium-2-yl)-4-methyl-pentanoate (2S)-2-isoindolin-2-ium-2-yl-4-methyl-pentanoate (2S)-2-isoindolin-2-ium-2-yl-4-methyl-valerate (2S)-2-isoindolin-2-yl-4-methyl-pentanoic acid (2S)-2-isoindolin-2-yl-4-methyl-valeric acid
Wiley ID 1577895