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1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-3-(2-methoxy-1-phenylethyl)-2-methyl-, (R*,S*)-(.+-.)-
SpectraBase Compound ID 5OXUWTQrSC5
InChI InChI=1S/C18H19NO3/c1-19-17(20)14-10-6-7-11-15(14)18(19,21)16(12-22-2)13-8-4-3-5-9-13/h3-11,16,21H,12H2,1-2H3/t16-,18+/m1/s1
InChIKey RAKQJONLDSGKMM-AEFFLSMTSA-N
Mol Weight 297.35 g/mol
Molecular Formula C18H19NO3
Exact Mass 297.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4od01WohK9S
Name 1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-3-(2-methoxy-1-phenylethyl)-2-methyl-, (R*,S*)-(.+-.)-
CAS Registry Number 95362-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO3
InChI InChI=1S/C18H19NO3/c1-19-17(20)14-10-6-7-11-15(14)18(19,21)16(12-22-2)13-8-4-3-5-9-13/h3-11,16,21H,12H2,1-2H3/t16-,18+/m1/s1
InChIKey RAKQJONLDSGKMM-AEFFLSMTSA-N
Molecular Weight 297.354 g/mol
SMILES O[C@]1(N(C(=O)c2c1cccc2)C)[C@@](c1ccccc1)(COC)[H]
SPLASH splash10-0w29-0920000000-5609350e0f82fad1d5ee
Source of Spectrum J-50-1431-3
Synonyms (3R)-3-hydroxy-3-[(1S)-2-methoxy-1-phenylethyl]-2-methyl-2,3-dihydro-1H-isoindol-1-one (R,s and s,R)-3-hydroxy-3-(2-methoxy-1-phenylethyl)-2-methylisoindolin-1-one
Wiley ID 1300241