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

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1-piperazinecarboxylic acid, 4-[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methylphenyl]sulfonyl]-, ethyl ester
SpectraBase Compound ID HsnCVRf8VH5
InChI InChI=1S/C19H27N3O7S2/c1-5-29-18(24)20-8-10-21(11-9-20)31(27,28)16-7-6-15(12-14(16)2)22-17(23)19(3,4)13-30(22,25)26/h6-7,12H,5,8-11,13H2,1-4H3
InChIKey MSZGSYCTNGEQCD-UHFFFAOYSA-N
Mol Weight 473.56 g/mol
Molecular Formula C19H27N3O7S2
Exact Mass 473.129043 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DaSFfz6B4jP
Name 1-piperazinecarboxylic acid, 4-[[4-(4,4-dimethyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)-2-methylphenyl]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/C19H27N3O7S2/c1-5-29-18(24)20-8-10-21(11-9-20)31(27,28)16-7-6-15(12-14(16)2)22-17(23)19(3,4)13-30(22,25)26/h6-7,12H,5,8-11,13H2,1-4H3
InChIKey MSZGSYCTNGEQCD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9413
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: F35343; Labnumber: CHEKAN-00379