SpectraBase Spectrum ID |
7Cwe4h5MWXx |
Name |
benzoic acid, 4-[(E)-(1,1-dioxido-4-oxo-2-(4-pyridinylmethyl)-2H-1,2-benzothiazin-3(4H)-ylidene)methyl]-, methyl 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/C23H18N2O5S/c1-30-23(27)18-8-6-16(7-9-18)14-20-22(26)19-4-2-3-5-21(19)31(28,29)25(20)15-17-10-12-24-13-11-17/h2-14H,15H2,1H3/b20-14+ |
InChIKey |
XNUCIOCVXLRTPO-XSFVSMFZSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_11628_4320 |
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: F20379; Labnumber: RROK-1548 |