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1H-Isoindol-1-one, 3-(2-ethoxy-1-methyl-1-phenylethyl)-2,3-dihydro-3-hydroxy-, (R*,R*)-(.+-.)-
SpectraBase Compound ID CJIaFNxYJT6
InChI InChI=1S/C19H21NO3/c1-3-23-13-18(2,14-9-5-4-6-10-14)19(22)16-12-8-7-11-15(16)17(21)20-19/h4-12,22H,3,13H2,1-2H3,(H,20,21)/t18-,19+/m0/s1
InChIKey ZJMMMQXJLDDGKA-RBUKOAKNSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10vZ9T5Hpxc
Name 1H-Isoindol-1-one, 3-(2-ethoxy-1-methyl-1-phenylethyl)-2,3-dihydro-3-hydroxy-, (R*,R*)-(.+-.)-
CAS Registry Number 95363-00-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-3-23-13-18(2,14-9-5-4-6-10-14)19(22)16-12-8-7-11-15(16)17(21)20-19/h4-12,22H,3,13H2,1-2H3,(H,20,21)/t18-,19+/m0/s1
InChIKey ZJMMMQXJLDDGKA-RBUKOAKNSA-N
Molecular Weight 311.381 g/mol
SMILES N1C(c2c([C@]1([C@](c1ccccc1)(COCC)C)O)cccc2)=O
SPLASH splash10-014i-0900000000-f841f88903b872607990
Source of Spectrum J-50-1433-14
Synonyms (3R)-3-[(1R)-2-ethoxy-1-methyl-1-phenylethyl]-3-hydroxy-2,3-dihydro-1H-isoindol-1-one 3-(2-Ethoxy-1-methyl-1-phenylethyl)-3-hydroxyisoindolin-1-one, diastereomer B
Wiley ID 1312590