Dataset
1H--1H correlation spectroscopy (1H-1H COSY)
Chemical Information
| InChI | InChI=1S/C21H26N2O3.ClH/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24;/h2-5,12,15,17-19,22,24H,6-11H2,1H3;1H/t12-,15-,17-,18-,19+;/m0./s1 |
|---|---|
| SMILES | COC(=O)[C@H]1[C@@H](O)CC[C@@H]2[C@@H]1C[C@@H]1N(C2)CCc2c1[nH]c1c2cccc1.Cl |
| InChI Key | PIPZGJSEDRMUAW-VJDCAHTMSA-N |
| Exact Mass | 390.904 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/PIPZGJSEDRMUAW-VJDCAHTMSA-N/CHMO0001150 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/PIPZGJSEDRMUAW-VJDCAHTMSA-N/CHMO0001150 |
| Version | |
| Author | Jean-Marie Lehn |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2026-05-18T07:22:14Z |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | 1H–1H correlation spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| No additional information available for this Dataset. | |