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4-piperidinecarboxylic acid, 1-[[2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)phenyl]sulfonyl]-, ethyl ester

View entire compound with spectra: 1 NMR

4-piperidinecarboxylic acid, 1-[[2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)phenyl]sulfonyl]-, ethyl ester
SpectraBase Compound ID 4xCgluVwqlS
InChI InChI=1S/C19H26N2O8S2/c1-4-29-19(23)14-7-9-20(10-8-14)31(26,27)17-11-15(5-6-16(17)28-3)21-18(22)13(2)12-30(21,24)25/h5-6,11,13-14H,4,7-10,12H2,1-3H3
InChIKey UYURPXZHJWBYQO-UHFFFAOYSA-N
Mol Weight 474.54 g/mol
Molecular Formula C19H26N2O8S2
Exact Mass 474.113058 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IWMY9Xlx6mF
Name 4-piperidinecarboxylic acid, 1-[[2-methoxy-5-(4-methyl-1,1-dioxido-3-oxo-2-isothiazolidinyl)phenyl]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/C19H26N2O8S2/c1-4-29-19(23)14-7-9-20(10-8-14)31(26,27)17-11-15(5-6-16(17)28-3)21-18(22)13(2)12-30(21,24)25/h5-6,11,13-14H,4,7-10,12H2,1-3H3
InChIKey UYURPXZHJWBYQO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8856
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: F33743; Labnumber: CHEKAN-00523