Dataset
correlation spectroscopy (COSY)
Chemical Info
| InChI | InChI=1S/C7H8/c1-3-5-7-6-4-2/h1-2H,5-7H2 |
|---|---|
| SMILES | C#CCCCC#C |
| InChI Key | RSPZSDWVQWRAEF-UHFFFAOYSA-N |
| Molecular Formula | C7H8 |
| Exact Mass | 92.138 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/RSPZSDWVQWRAEF-UHFFFAOYSA-N/CHMO0000599 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/RSPZSDWVQWRAEF-UHFFFAOYSA-N/CHMO0000599 |
| Version | |
| Author | Simone Gräßle |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-01-29T10:01:21.323457 |
| MetadataModified | 2025-02-04T11:37:31.926694 |
| MetadataPublished | 2024-09-06 |
| Related Molecule |