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3-[HYDROXY-(4-METHOXYPHENYL)-METHYL]-6-METHOXY-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3S*)-ISOMER
SpectraBase Compound ID 5H6WrRGMdGb
InChI InChI=1S/C17H17NO4/c1-21-11-5-3-10(4-6-11)16(19)15-13-8-7-12(22-2)9-14(13)17(20)18-15/h3-9,15-16,19H,1-2H3,(H,18,20)/t15-,16-/m0/s1
InChIKey SCVLTTJJEFRMQT-HOTGVXAUSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qblW6RBmi1
Name 3-[HYDROXY-(4-METHOXYPHENYL)-METHYL]-6-METHOXY-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3S*)-ISOMER
Compound Number 32B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-21-11-5-3-10(4-6-11)16(19)15-13-8-7-12(22-2)9-14(13)17(20)18-15/h3-9,15-16,19H,1-2H3,(H,18,20)/t15-,16-/m0/s1
InChIKey SCVLTTJJEFRMQT-HOTGVXAUSA-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 299.326 g/mol
Solvent DMSO-D6
Source File Reference UWBT9630