Dataset
electron ionisation mass spectrometry (EI-MS)
Chemical Information
| InChI | InChI=1S/C24H22O4/c1-15-13-22(18-7-11-20(12-8-18)24(26)28-4)16(2)14-21(15)17-5-9-19(10-6-17)23(25)27-3/h5-14H,1-4H3 |
|---|---|
| SMILES | COC(=O)c1ccc(cc1)c1cc(C)c(cc1C)c1ccc(cc1)C(=O)OC |
| InChI Key | AEPVXWVYURFHLS-UHFFFAOYSA-N |
| Molecular Formula | C24H22O4 |
| Exact Mass | 374.429 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/AEPVXWVYURFHLS-UHFFFAOYSA-N/Mass/EI |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/AEPVXWVYURFHLS-UHFFFAOYSA-N/Mass/EI |
| Version | |
| Author | Sylvain Grosjean |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2014-05-27 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | electron ionisation mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 73427293 | PubChem |
| KOWXOM | CCDC |
| The data in this table is sourced from UniChem at EBI. | |