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2-(4-tert-butylbenzyl)-3-hydroxy-3-phenyl-isoindolin-1-one
SpectraBase Compound ID 5P9pWDdH6LA
InChI InChI=1S/C25H25NO2/c1-24(2,3)19-15-13-18(14-16-19)17-26-23(27)21-11-7-8-12-22(21)25(26,28)20-9-5-4-6-10-20/h4-16,28H,17H2,1-3H3
InChIKey KZDCAAUYWZQKRT-UHFFFAOYSA-N
Mol Weight 371.48 g/mol
Molecular Formula C25H25NO2
Exact Mass 371.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCeFY9gpcGX
Name 2-(4-tert-butylbenzyl)-3-hydroxy-3-phenyl-isoindolin-1-one
Alternate Name(s) 2-[(4-tert-butylphenyl)methyl]-3-hydroxy-3-phenyl-1-isoindolone 2-[(4-tert-butylphenyl)methyl]-3-hydroxy-3-phenyl-isoindolin-1-one 2-[(4-tert-butylphenyl)methyl]-3-hydroxy-3-phenylisoindol-1-one 2-[(4-tert-butylphenyl)methyl]-3-oxidanyl-3-phenyl-isoindol-1-one
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Formula C25H25NO2
InChI InChI=1S/C25H25NO2/c1-24(2,3)19-15-13-18(14-16-19)17-26-23(27)21-11-7-8-12-22(21)25(26,28)20-9-5-4-6-10-20/h4-16,28H,17H2,1-3H3
InChIKey KZDCAAUYWZQKRT-UHFFFAOYSA-N
Molecular Weight 371.480 g/mol
SMILES OC1(N(C(c2c1cccc2)=O)Cc1ccc(cc1)C(C)(C)C)c1ccccc1
SPLASH splash10-03di-2910000000-32977f9c73c277193106
Wiley ID 1437880