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3-(1-HYDROXY-1-PHENYLMETHYL)-4-METHOXY-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3S*)-ISOMER
SpectraBase Compound ID 64uLiPLeJ4t
InChI InChI=1S/C17H17NO3/c1-17(20,11-7-4-3-5-8-11)15-14-12(16(19)18-15)9-6-10-13(14)21-2/h3-10,15,20H,1-2H3,(H,18,19)/t15-,17+/m0/s1
InChIKey XNAPZTGFFNFMSM-DOTOQJQBSA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cb97JS25ELI
Name 3-(1-HYDROXY-1-PHENYLMETHYL)-4-METHOXY-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3S*)-ISOMER
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-17(20,11-7-4-3-5-8-11)15-14-12(16(19)18-15)9-6-10-13(14)21-2/h3-10,15,20H,1-2H3,(H,18,19)/t15-,17+/m0/s1
InChIKey XNAPZTGFFNFMSM-DOTOQJQBSA-N
Literature Reference Author K.SMITH,G.A.EL-HITI,A.S.HEGAZY,B.KARIUKI
Literature Reference Citation BEIL.J.ORG.CHEM.,7,1219(2011)
Literature Reference DOI 10.3762/bjoc.7.142
Molecular Weight 283.327 g/mol
Solvent DMSO-D6
Source File Reference UWBT9610