Dataset
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
| InChI | InChI=1S/C21H23NO4/c1-2-3-12-19(20(23)24)22-21(25)26-13-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,2-3,12-13H2,1H3,(H,22,25)(H,23,24)/t19-/m1/s1 |
|---|---|
| SMILES | CCCC[C@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2 |
| InChI Key | VCFCFPNRQDANPN-LJQANCHMSA-N |
| Molecular Formula | C21H23NO4 |
| Exact Mass | 353.412 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/VCFCFPNRQDANPN-LJQANCHMSA-N/CHMO0001148 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/VCFCFPNRQDANPN-LJQANCHMSA-N/CHMO0001148 |
| Version | |
| Author | Sylvia Vanderheiden-Schroen |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-01-29T10:19:01.356180 |
| MetadataModified | 2025-01-29T16:12:09.483987 |
| MetadataPublished | 2024-11-08 |
| Related Molecule |