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

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1-piperazinecarboxylic acid, 4-[[5-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methoxyphenyl]sulfonyl]-, ethyl ester
SpectraBase Compound ID 8kSalVa6Vk7
InChI InChI=1S/C19H27N3O8S2/c1-5-30-18(24)20-8-10-21(11-9-20)32(27,28)16-12-14(6-7-15(16)29-4)22-17(23)19(2,3)13-31(22,25)26/h6-7,12H,5,8-11,13H2,1-4H3
InChIKey WIQPKLPQHREHOC-UHFFFAOYSA-N
Mol Weight 489.56 g/mol
Molecular Formula C19H27N3O8S2
Exact Mass 489.123957 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GANPfByqhXs
Name 1-piperazinecarboxylic acid, 4-[[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/C19H27N3O8S2/c1-5-30-18(24)20-8-10-21(11-9-20)32(27,28)16-12-14(6-7-15(16)29-4)22-17(23)19(2,3)13-31(22,25)26/h6-7,12H,5,8-11,13H2,1-4H3
InChIKey WIQPKLPQHREHOC-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8909
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: F33812; Labnumber: CHEKAN-00670