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N-[4-(2-anilino-2-oxoethoxy)-2-bromo-5-ethoxybenzyl]-2-phenylethanaminium chloride
SpectraBase Compound ID LYbgFrg6OyU
InChI InChI=1S/C25H27BrN2O3.ClH/c1-2-30-23-15-20(17-27-14-13-19-9-5-3-6-10-19)22(26)16-24(23)31-18-25(29)28-21-11-7-4-8-12-21;/h3-12,15-16,27H,2,13-14,17-18H2,1H3,(H,28,29);1H
InChIKey ZBLVHVQWFXMXFU-UHFFFAOYSA-N
Mol Weight 519.87 g/mol
Molecular Formula C25H28BrClN2O3
Exact Mass 518.097183 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7feEQRSbUk1
Name N-[4-(2-anilino-2-oxoethoxy)-2-bromo-5-ethoxybenzyl]-2-phenylethanaminium chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H27BrN2O3.ClH/c1-2-30-23-15-20(17-27-14-13-19-9-5-3-6-10-19)22(26)16-24(23)31-18-25(29)28-21-11-7-4-8-12-21;/h3-12,15-16,27H,2,13-14,17-18H2,1H3,(H,28,29);1H
InChIKey ZBLVHVQWFXMXFU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31489
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 1842907; SBI_ID: SBI-031493
Temperature 308 °C