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3-Hydroxy-3-(2-methoxy-1-phenylethyl)isoindolin-1-one, diastereomer a

View entire compound with spectra: 2 MS (GC)

3-Hydroxy-3-(2-methoxy-1-phenylethyl)isoindolin-1-one, diastereomer a
SpectraBase Compound ID 5cYkodvtMsU
InChI InChI=1S/C17H17NO3/c1-21-11-15(12-7-3-2-4-8-12)17(20)14-10-6-5-9-13(14)16(19)18-17/h2-10,15,20H,11H2,1H3,(H,18,19)
InChIKey NEBSKHNEPVVTKS-UHFFFAOYSA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MHdf69vGRB
Name 3-Hydroxy-3-(2-methoxy-1-phenylethyl)isoindolin-1-one, diastereomer a
Alternate Name(s) 3-Hydroxy-3-(2-methoxy-1-phenylethyl)isoindolin-1-one 3-Hydroxy-3-(2-methoxy-1-phenylethyl)-1-isoindolinone
CAS Registry Number 95362-94-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-21-11-15(12-7-3-2-4-8-12)17(20)14-10-6-5-9-13(14)16(19)18-17/h2-10,15,20H,11H2,1H3,(H,18,19)
InChIKey NEBSKHNEPVVTKS-UHFFFAOYSA-N
Molecular Weight 283.327 g/mol
SMILES N1C(c2c(C1(C(c1ccccc1)COC)O)cccc2)=O
SPLASH splash10-0f89-0790000000-1ff674b80ea7ad649fdb
Source of Spectrum J-50-1433-11
Wiley ID 1287076