SpectraBase Spectrum ID |
7cZx8M54a78 |
Name |
{3-[(1E)-3-(3-bromoanilino)-2-cyano-3-oxo-1-propenyl]-1H-indol-1-yl}acetic acid |
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/C20H14BrN3O3/c21-15-4-3-5-16(9-15)23-20(27)13(10-22)8-14-11-24(12-19(25)26)18-7-2-1-6-17(14)18/h1-9,11H,12H2,(H,23,27)(H,25,26)/b13-8+ |
InChIKey |
SLRZDLHTRSEMIP-MDWZMJQESA-N |
NMR Offset |
15.328 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_16200 |
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: D22181; Labnumber: AREF2K-0411; SBI_ID: SBI-016203 |
Synonyms |
{3-[3-(3-bromoanilino)-2-cyano-3-oxo-1-propenyl]-1H-indol-1-yl}acetic acid |
Temperature |
318 °C |