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N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanaminium chloride

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N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanaminium chloride
SpectraBase Compound ID CNWEA6MNZqB
InChI InChI=1S/C24H31NO3.ClH/c1-23(2)17-24(11-13-28-23,15-19-6-4-3-5-7-19)10-12-25-16-20-8-9-21-22(14-20)27-18-26-21;/h3-9,14,25H,10-13,15-18H2,1-2H3;1H
InChIKey DJUZSOXWQMTYTB-UHFFFAOYSA-N
Mol Weight 418.0 g/mol
Molecular Formula C24H32ClNO3
Exact Mass 417.207072 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1zVW9YRY1un
Name N-(1,3-benzodioxol-5-ylmethyl)-2-(4-benzyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)ethanaminium 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/C24H31NO3.ClH/c1-23(2)17-24(11-13-28-23,15-19-6-4-3-5-7-19)10-12-25-16-20-8-9-21-22(14-20)27-18-26-21;/h3-9,14,25H,10-13,15-18H2,1-2H3;1H
InChIKey DJUZSOXWQMTYTB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12569
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: 100855; Labnumber: AEGU9-0071; VK_ID: VK-012574
Temperature 308 °C