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4-piperidinecarboxylic acid, 1-[[5-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methoxyphenyl]sulfonyl]-, ethyl ester

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4-piperidinecarboxylic acid, 1-[[5-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methoxyphenyl]sulfonyl]-, ethyl ester
SpectraBase Compound ID ATMVFAdRmqY
InChI InChI=1S/C20H28N2O8S2/c1-5-30-18(23)14-8-10-21(11-9-14)32(27,28)17-12-15(6-7-16(17)29-4)22-19(24)20(2,3)13-31(22,25)26/h6-7,12,14H,5,8-11,13H2,1-4H3
InChIKey HIUZLUPNUYYJMH-UHFFFAOYSA-N
Mol Weight 488.57 g/mol
Molecular Formula C20H28N2O8S2
Exact Mass 488.128708 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 25fx1TcW8DF
Name 4-piperidinecarboxylic acid, 1-[[5-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methoxyphenyl]sulfonyl]-, ethyl ester
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/C20H28N2O8S2/c1-5-30-18(23)14-8-10-21(11-9-14)32(27,28)17-12-15(6-7-16(17)29-4)22-19(24)20(2,3)13-31(22,25)26/h6-7,12,14H,5,8-11,13H2,1-4H3
InChIKey HIUZLUPNUYYJMH-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8908
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: F33811; Labnumber: CHEKAN-00667