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N-[2-bromo-5-ethoxy-4-(2-propynyloxy)benzyl]-2-phenylethanaminium chloride
SpectraBase Compound ID 7bUDyi52kFs
InChI InChI=1S/C20H22BrNO2.ClH/c1-3-12-24-20-14-18(21)17(13-19(20)23-4-2)15-22-11-10-16-8-6-5-7-9-16;/h1,5-9,13-14,22H,4,10-12,15H2,2H3;1H
InChIKey DFQMMYDAWZUWBE-UHFFFAOYSA-N
Mol Weight 424.77 g/mol
Molecular Formula C20H23BrClNO2
Exact Mass 423.06007 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E3V7x3drwNU
Name N-[2-bromo-5-ethoxy-4-(2-propynyloxy)benzyl]-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/C20H22BrNO2.ClH/c1-3-12-24-20-14-18(21)17(13-19(20)23-4-2)15-22-11-10-16-8-6-5-7-9-16;/h1,5-9,13-14,22H,4,10-12,15H2,2H3;1H
InChIKey DFQMMYDAWZUWBE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32011
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: 1844464; SBI_ID: SBI-032015
Temperature 318 °C