1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(3-methoxybenzyl)piperazine oxalate

SpectraBase Compound ID	Iu4JhYkaGnJ
InChI	InChI=1S/C21H26N2O4.C2H2O4/c1-24-18-5-3-4-16(10-18)13-22-6-8-23(9-7-22)14-17-11-19(25-2)21-20(12-17)26-15-27-21;3-1(4)2(5)6/h3-5,10-12H,6-9,13-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey	ACZGNSNEAKKJQT-UHFFFAOYSA-N Google Search
Mol Weight	460.48 g/mol
Molecular Formula	C23H28N2O8
Exact Mass	460.184566 g/mol

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SpectraBase Spectrum ID	3cK3S7Qs9Lr
Name	1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(3-methoxybenzyl)piperazine 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/C21H26N2O4.C2H2O4/c1-24-18-5-3-4-16(10-18)13-22-6-8-23(9-7-22)14-17-11-19(25-2)21-20(12-17)26-15-27-21;3-1(4)2(5)6/h3-5,10-12H,6-9,13-15H2,1-2H3;(H,3,4)(H,5,6)
InChIKey	ACZGNSNEAKKJQT-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_16805
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: UZI/9029890; Labnumber: PPZ2-7665; UZI_ID: UZI-016809
Temperature	318 °C