NMR data for 1-(4-methoxybenzyl)-1H-pyrazol-5-ol (9), enol, 1H, 13C, HMBC
DOI: 10.14469/hpc/11850 Metadata
Created: 2022-11-13 18:08
Last modified: 2024-05-28 09:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Primary NMR data for compound 9.
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| 9-enol form hmbc.zip | 1MB | application/zip | Bruker primary data archive |
| 9-enol form hmbc.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for 9-enol form hmbc.zip |
| 9-enol form hmbc.mnova | 1MB | chemical/x-mnova | Mnova data archive |
| 9-enol form hmbc.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for 9-enol form hmbc.mnova |
| 9-enol form hmbc.jdx | 754KB | chemical/x-jcamp-dx | JCAMP-DX Spectrum |
| 9-enol form hmbc.pdf | 39KB | application/pdf | Spectrum as PDF |
| 9.png | 427KB | image/png | Image structural representation |
| 9.mol | 4KB | chemical/x-mdl-molfile | MDL Molfile |
| 9.cdxml | 13KB | chemical/x-cdxml | Chemdraw connection table |
| 9.cdxml | 10KB | chemical/x-cdxml | Chemdraw connection table v2 |
| 9.png | 39KB | image/png | Image structural representation v2 |
| 9.mol | 2KB | chemical/x-mdl-molfile | MDL Molfile v2 |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/11829 | NMR Data for Compound 9. |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/C11H12N2O2/c1-15-10-4-2-9(3-5-10)8-13-11(14)6-7-12-13/h2-5,7H,6,8H2,1H3 |
| inchikey | RDXMBFOQVILFPM-UHFFFAOYSA-N |
| NMR_Expt | HMBC |
| NMR_Nucleus1 | 1H |
| NMR_Nucleus2 | 13C |
| SMILES | O=C1N(CC2=CC=C(OC)C=C2)N=CC1>>OC3=CC=NN3CC4=CC=C(OC)C=C4 |