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benzoic acid, 4-[[3,4-dihydro-4-hydroxy-1,1-dioxido-2-(4-pyridinylmethyl)-2H-1,2-benzothiazin-3-yl]methyl]-, 1-methylethyl ester

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benzoic acid, 4-[[3,4-dihydro-4-hydroxy-1,1-dioxido-2-(4-pyridinylmethyl)-2H-1,2-benzothiazin-3-yl]methyl]-, 1-methylethyl ester
SpectraBase Compound ID 4jb9s8BJlVT
InChI InChI=1S/C25H26N2O5S/c1-17(2)32-25(29)20-9-7-18(8-10-20)15-22-24(28)21-5-3-4-6-23(21)33(30,31)27(22)16-19-11-13-26-14-12-19/h3-14,17,22,24,28H,15-16H2,1-2H3
InChIKey WEXJLPQYWLKCQB-UHFFFAOYSA-N
Mol Weight 466.55 g/mol
Molecular Formula C25H26N2O5S
Exact Mass 466.156243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9TrjaUrg3K
Name benzoic acid, 4-[[3,4-dihydro-4-hydroxy-1,1-dioxido-2-(4-pyridinylmethyl)-2H-1,2-benzothiazin-3-yl]methyl]-, 1-methylethyl 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/C25H26N2O5S/c1-17(2)32-25(29)20-9-7-18(8-10-20)15-22-24(28)21-5-3-4-6-23(21)33(30,31)27(22)16-19-11-13-26-14-12-19/h3-14,17,22,24,28H,15-16H2,1-2H3
InChIKey WEXJLPQYWLKCQB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_10844
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: F38475; Labnumber: RROK-1571
Temperature 315 °C