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3-(1,3-benzodioxol-5-yl)-N-(4-methoxybenzyl)-3-(2-methoxyphenyl)-1-propanaminium

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3-(1,3-benzodioxol-5-yl)-N-(4-methoxybenzyl)-3-(2-methoxyphenyl)-1-propanaminium
SpectraBase Compound ID G3TRDCi98iB
InChI InChI=1S/C25H27NO4/c1-27-20-10-7-18(8-11-20)16-26-14-13-21(22-5-3-4-6-23(22)28-2)19-9-12-24-25(15-19)30-17-29-24/h3-12,15,21,26H,13-14,16-17H2,1-2H3/p+1
InChIKey LBMRVOOUBNQXAX-UHFFFAOYSA-O
Mol Weight 406.5 g/mol
Molecular Formula C25H28NO4
Exact Mass 406.201833 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G4PmwOa3TBk
Name 3-(1,3-benzodioxol-5-yl)-N-(4-methoxybenzyl)-3-(2-methoxyphenyl)-1-propanaminium
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/C25H27NO4/c1-27-20-10-7-18(8-11-20)16-26-14-13-21(22-5-3-4-6-23(22)28-2)19-9-12-24-25(15-19)30-17-29-24/h3-12,15,21,26H,13-14,16-17H2,1-2H3/p+1
InChIKey LBMRVOOUBNQXAX-UHFFFAOYSA-O
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12567
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: 100846; Labnumber: AEGU9-0035; VK_ID: VK-012572
Temperature 308 °C