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beta-alanine, N-[2-(4-hydroxyphenyl)-1,1-dimethylethyl]-3-oxo-, 2-[(E)-(3,4-dimethoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID 4GUctiEVroV
InChI InChI=1S/C22H27N3O5/c1-22(2,13-15-5-8-17(26)9-6-15)24-20(27)12-21(28)25-23-14-16-7-10-18(29-3)19(11-16)30-4/h5-11,14,26H,12-13H2,1-4H3,(H,24,27)(H,25,28)/b23-14+
InChIKey XWTHQORMNMPRLU-OEAKJJBVSA-N
Mol Weight 413.47 g/mol
Molecular Formula C22H27N3O5
Exact Mass 413.195071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID dk4Ik7U3a1
Name beta-alanine, N-[2-(4-hydroxyphenyl)-1,1-dimethylethyl]-3-oxo-, 2-[(E)-(3,4-dimethoxyphenyl)methylidene]hydrazide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.195070976 u
Formula C22H27N3O5
InChI InChI=1S/C22H27N3O5/c1-22(2,13-15-5-8-17(26)9-6-15)24-20(27)12-21(28)25-23-14-16-7-10-18(29-3)19(11-16)30-4/h5-11,14,26H,12-13H2,1-4H3,(H,24,27)(H,25,28)/b23-14+
InChIKey XWTHQORMNMPRLU-OEAKJJBVSA-N
Molecular Weight 413.474 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8460
Solvent DMSO-d6
Source Vendor ID: NMR/9322512; Lab Info: VG; Lab Number: VG-0001005