2-(benzo[d][1,3]dioxol-5-yl)-N-(3-bromobenzyl)-N-(4-ethoxybenzyl)ethanamine oxalate

SpectraBase Compound ID	6bHQfeOIv8i
InChI	InChI=1S/C25H26BrNO3.C2H2O4/c1-2-28-23-9-6-20(7-10-23)16-27(17-21-4-3-5-22(26)14-21)13-12-19-8-11-24-25(15-19)30-18-29-24;3-1(4)2(5)6/h3-11,14-15H,2,12-13,16-18H2,1H3;(H,3,4)(H,5,6)
InChIKey	JVGAHTBVYCVDCU-UHFFFAOYSA-N Google Search
Mol Weight	558.43 g/mol
Molecular Formula	C27H28BrNO7
Exact Mass	557.104915 g/mol

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SpectraBase Spectrum ID	JO80PeBix2u
Name	2-(benzo[d][1,3]dioxol-5-yl)-N-(3-bromobenzyl)-N-(4-ethoxybenzyl)ethanamine oxalate
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/C25H26BrNO3.C2H2O4/c1-2-28-23-9-6-20(7-10-23)16-27(17-21-4-3-5-22(26)14-21)13-12-19-8-11-24-25(15-19)30-18-29-24;3-1(4)2(5)6/h3-11,14-15H,2,12-13,16-18H2,1H3;(H,3,4)(H,5,6)
InChIKey	JVGAHTBVYCVDCU-UHFFFAOYSA-N
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_3088
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: NMR/10228713