Data · dataset · 2026
NMR, IR, and HRMS data related to the synthesis of nitrogenated aromatics from 2-pyrones
Listed in REDU - Unicamp Institutional Research Data Repository
This dataset contains the raw spectroscopic data (NMR, HRMS, and IR) for all final compounds obtained in the study entitled “Cascade Iodine-Catalyzed Synthesis of Nitrogenated Aromatics from 2-Pyrones.” The data were generated to support the structural characterization and confirmation of the synthesized compounds.
Description
All compounds were prepared following iodine-catalyzed cascade reactions starting from 2-pyrones and suitable nitrogen sources, as described in the associated study.
The spectroscopic data were collected using standard analytical techniques, including nuclear magnetic resonance (NMR), high-resolution mass spectrometry (HRMS), and infrared spectroscopy (IR). The dataset consists of unprocessed (raw) spectra files, providing full experimental evidence of compound identity and purity. These data are intended to ensure transparency, reproducibility, and validation of the reported results, and may be used for comparison, reanalysis, or further methodological development by other researchers.
Links
Where it is published
- Dataverse dataset page redu.unicamp.br/dataset.xhtml?persistentId=doi%3A10.25824%2Fredu%2FCI2IKZ ↗
landing page · from redu unicamp br
- DOI doi.org/10.25824/redu/ci2ikz ↗
DOI / persistent id · from redu unicamp br
Catalogue records · 1
- Dataverse API redu.unicamp.br/api/datasets/:persistentId/?persistentId=doi%3A10.25824%2Fredu… ↗
metadata API · from redu unicamp br
Topics
- Stated by source
- Chemistry
- From keywords
- Chemistry
- Inferred from text
- Magnetic resonance imaging 65% · Mass spectrometry 75% · Organic chemistry 73%
Provenance · 1 source records, 11 field assertions
| Source | Key | Last seen | Raw |
|---|---|---|---|
| REDU - Unicamp Institutional Research Data Repository | doi:10.25824/redu/CI2IKZ | 8 d ago | JSON v1 |
| Field | Assertion | Extractor | Evidence |
|---|---|---|---|
| concepts[field].anzsrc:group:3405 | enrichment · redu unicamp br | taxonomy-embedding@1.1.0 | title+keywords+description (73%) |
| concepts[field].dataverse_subject:chemistry | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | /subjects |
| concepts[field].local:field:chemistry | mapping · redu unicamp br | connector:redu_unicamp_br@1.0.0 | /subjects |
| concepts[modality].local:modality:mass-spectrometry | enrichment · redu unicamp br | keyword-concept-rules@1.0.0 | title+description (75%) |
| concepts[modality].local:modality:mri | enrichment · redu unicamp br | keyword-concept-rules@1.0.0 | title+description (65%) |
| created_date | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | |
| description | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | /description |
| publication_date | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | |
| title | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | /name |
| updated_date | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 | |
| version_label | source · redu unicamp br | connector:redu_unicamp_br@1.0.0 |