| SpectraBase Spectrum ID |
AbbWXerWqhA |
| Name |
4-{3-[(1E)-3-(4-bromoanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic 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/C23H18BrN3O3/c1-14-11-17(15(2)27(14)21-9-3-16(4-10-21)23(29)30)12-18(13-25)22(28)26-20-7-5-19(24)6-8-20/h3-12H,1-2H3,(H,26,28)(H,29,30)/b18-12+ |
| InChIKey |
XGKVFUOTVYEPLE-LDADJPATSA-N |
| NMR Offset |
15.5012 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UZI_26187_2774 |
| 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: UZI/1011165; Labnumber: ARF3682; UZI_ID: UZI-002776 |
| Synonyms |
4-{3-[3-(4-bromoanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid |
| Temperature |
315 °C |
![4-{3-[(1E)-3-(4-bromoanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid](/api/spectrum/AbbWXerWqhA/structure.png?h=300&w=458 "4-{3-[(1E)-3-(4-bromoanilino)-2-cyano-3-oxo-1-propenyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoic acid")
