| SpectraBase Spectrum ID |
GhCd4AiORVL |
| Name |
3-{2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-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/C16H11N3O4S/c20-13-12(14(21)18-16(24)17-13)8-11-5-2-6-19(11)10-4-1-3-9(7-10)15(22)23/h1-8H,(H,22,23)(H2,17,18,20,21,24) |
| InChIKey |
SHUAJKHTCHSDLN-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_8368 |
| 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: D36179; Labnumber: SPDEM5-38151; SBI_ID: SBI-008371 |
| Temperature |
318 °C |
![3-{2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid](/api/spectrum/GhCd4AiORVL/structure.png?h=300&w=458 "3-{2-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-pyrrol-1-yl}benzoic acid")
