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3-(2-ethoxy-1-methyl-phenylethyl)-3-hydroxy-2-methylisoindolin-1-one, diastetreomer a
SpectraBase Compound ID 7xbl6mSQGhc
InChI InChI=1S/C20H23NO3/c1-14(18(24-3)15-9-5-4-6-10-15)20(23)13-16-11-7-8-12-17(16)19(22)21(20)2/h4-12,14,18,23H,13H2,1-3H3
InChIKey WZKRIAAGYGAPNS-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5f9ISSU54bu
Name 3-(2-ethoxy-1-methyl-phenylethyl)-3-hydroxy-2-methylisoindolin-1-one, diastetreomer a
CAS Registry Number 95363-20-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-14(18(24-3)15-9-5-4-6-10-15)20(23)13-16-11-7-8-12-17(16)19(22)21(20)2/h4-12,14,18,23H,13H2,1-3H3
InChIKey WZKRIAAGYGAPNS-UHFFFAOYSA-N
Molecular Weight 325.408 g/mol
SMILES OC1(N(C(=O)c2c(C1)cccc2)C)C(C(c1ccccc1)OC)C
SPLASH splash10-014i-0900000000-3b5856759952ea78c19f
Source of Spectrum J-50-1432-10
Synonyms 3-hydroxy-3-(2-methoxy-1-methyl-2-phenylethyl)-2-methyl-3,4-dihydro-1(2H)-isoquinolinone
Wiley ID 1324160