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beta-alanine, N-[2-(4-hydroxyphenyl)-1,1-dimethylethyl]-3-oxo-, 2-[(E)-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylidene]hydrazide
SpectraBase Compound ID 6QI4xI6sqi7
InChI InChI=1S/C28H39N3O4/c1-26(2,3)21-13-19(14-22(25(21)35)27(4,5)6)17-29-31-24(34)15-23(33)30-28(7,8)16-18-9-11-20(32)12-10-18/h9-14,17,32,35H,15-16H2,1-8H3,(H,30,33)(H,31,34)/b29-17+
InChIKey SZRZUAITBANRQU-STBIYBPSSA-N
Mol Weight 481.6 g/mol
Molecular Formula C28H39N3O4
Exact Mass 481.294057 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9H4lWlTCUSc
Name beta-alanine, N-[2-(4-hydroxyphenyl)-1,1-dimethylethyl]-3-oxo-, 2-[(E)-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]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 481.294056744 u
Formula C28H39N3O4
InChI InChI=1S/C28H39N3O4/c1-26(2,3)21-13-19(14-22(25(21)35)27(4,5)6)17-29-31-24(34)15-23(33)30-28(7,8)16-18-9-11-20(32)12-10-18/h9-14,17,32,35H,15-16H2,1-8H3,(H,30,33)(H,31,34)/b29-17+
InChIKey SZRZUAITBANRQU-STBIYBPSSA-N
Molecular Weight 481.637 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8461
Solvent DMSO-d6
Source Vendor ID: NMR/9322513; Lab Info: VG; Lab Number: VG-0001006