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1H-isoindol-1-one, 2-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-3-hydroxy-3-(phenylmethyl)-
SpectraBase Compound ID KQ2jeIfhrA1
InChI InChI=1S/C25H25NO4/c1-29-22-13-12-18(16-23(22)30-2)14-15-26-24(27)20-10-6-7-11-21(20)25(26,28)17-19-8-4-3-5-9-19/h3-13,16,28H,14-15,17H2,1-2H3
InChIKey OXCDRVNXONCNKZ-UHFFFAOYSA-N
Mol Weight 403.48 g/mol
Molecular Formula C25H25NO4
Exact Mass 403.178358 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DIgNPSiiuNj
Name 1H-isoindol-1-one, 2-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-3-hydroxy-3-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.178358285 u
Formula C25H25NO4
InChI InChI=1S/C25H25NO4/c1-29-22-13-12-18(16-23(22)30-2)14-15-26-24(27)20-10-6-7-11-21(20)25(26,28)17-19-8-4-3-5-9-19/h3-13,16,28H,14-15,17H2,1-2H3
InChIKey OXCDRVNXONCNKZ-UHFFFAOYSA-N
Molecular Weight 403.478 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4292
Solvent DMSO-d6
Source Vendor ID: NMR/9290838; Lab Info: RAI; Lab Number: RAI-bpr0016