SpectraBase Spectrum ID |
9JEEs93IECV |
Name |
1H-indole-3-carboxylic acid, 5-(acetyloxy)-6-bromo-1-methyl-2-[(phenylthio)methyl]-, 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/C21H20BrNO4S/c1-4-26-21(25)20-15-10-19(27-13(2)24)16(22)11-17(15)23(3)18(20)12-28-14-8-6-5-7-9-14/h5-11H,4,12H2,1-3H3 |
InChIKey |
PLUCUIPGCPBWEW-UHFFFAOYSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_8516_3795 |
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: ZI/6053158; Labnumber: JMR-0223; IOH_ID: IOH-010798 |
Temperature |
303 °C |