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1-piperidinecarboxylic acid, 4-[1-[(3-chloro-4-methoxyphenyl)amino]-1,3-dihydro-3-oxo-2H-isoindol-2-yl]-, ethyl ester
SpectraBase Compound ID BARxIY8JX1z
InChI InChI=1S/C23H26ClN3O4/c1-3-31-23(29)26-12-10-16(11-13-26)27-21(17-6-4-5-7-18(17)22(27)28)25-15-8-9-20(30-2)19(24)14-15/h4-9,14,16,21,25H,3,10-13H2,1-2H3
InChIKey VUYVTQMGADVJBU-UHFFFAOYSA-N
Mol Weight 443.93 g/mol
Molecular Formula C23H26ClN3O4
Exact Mass 443.161184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FuWPORARq51
Name 1-piperidinecarboxylic acid, 4-[1-[(3-chloro-4-methoxyphenyl)amino]-1,3-dihydro-3-oxo-2H-isoindol-2-yl]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.161184025 u
Formula C23H26ClN3O4
InChI InChI=1S/C23H26ClN3O4/c1-3-31-23(29)26-12-10-16(11-13-26)27-21(17-6-4-5-7-18(17)22(27)28)25-15-8-9-20(30-2)19(24)14-15/h4-9,14,16,21,25H,3,10-13H2,1-2H3
InChIKey VUYVTQMGADVJBU-UHFFFAOYSA-N
Molecular Weight 443.931 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2938
Solvent DMSO-d6
Source Vendor ID: NMR/12689621