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N~1~-[2-bromo-4-(cyclopentyloxy)-5-methoxybenzyl]-N~2~,N~2~-dimethyl-1,2-ethanediaminium dichloride
SpectraBase Compound ID IBfaYEhpZBt
InChI InChI=1S/C17H27BrN2O2.2ClH/c1-20(2)9-8-19-12-13-10-16(21-3)17(11-15(13)18)22-14-6-4-5-7-14;;/h10-11,14,19H,4-9,12H2,1-3H3;2*1H
InChIKey RHULBFGQJGPRDO-UHFFFAOYSA-N
Mol Weight 444.24 g/mol
Molecular Formula C17H29BrCl2N2O2
Exact Mass 442.078947 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LiFALYszDOM
Name N~1~-[2-bromo-4-(cyclopentyloxy)-5-methoxybenzyl]-N~2~,N~2~-dimethyl-1,2-ethanediaminium dichloride
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/C17H27BrN2O2.2ClH/c1-20(2)9-8-19-12-13-10-16(21-3)17(11-15(13)18)22-14-6-4-5-7-14;;/h10-11,14,19H,4-9,12H2,1-3H3;2*1H
InChIKey RHULBFGQJGPRDO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32027
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: 1844483; SBI_ID: SBI-032031
Temperature 318 °C