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1,1-dimethyl-4-[(3-methyl-2-phenylpentanoyl)oxy]piperidinium methanesulfonate
SpectraBase Compound ID B6JQxG8VGUs
InChI InChI=1S/C19H30NO2.CH4O3S/c1-5-15(2)18(16-9-7-6-8-10-16)19(21)22-17-11-13-20(3,4)14-12-17;1-5(2,3)4/h6-10,15,17-18H,5,11-14H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey FJAVUVKFBFESFW-UHFFFAOYSA-M
Mol Weight 399.55 g/mol
Molecular Formula C20H33NO5S
Exact Mass 399.207944 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C1rXQug7Od8
Name 1,1-dimethyl-4-[(3-methyl-2-phenylpentanoyl)oxy]piperidinium methanesulfonate
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/C19H30NO2.CH4O3S/c1-5-15(2)18(16-9-7-6-8-10-16)19(21)22-17-11-13-20(3,4)14-12-17;1-5(2,3)4/h6-10,15,17-18H,5,11-14H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey FJAVUVKFBFESFW-UHFFFAOYSA-M
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17313
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: 987/00005322; Labnumber: 987/00005322218865; VK_ID: VK-017318
Temperature 315 °C