Dataset
high resolution fast-atom bombardment mass spectrometry (HRFABMS)
Chemical Information
| InChI | InChI=1S/C17H17NO/c19-12-18-17-11-15-6-5-13-1-3-14(4-2-13)7-9-16(17)10-8-15/h1-4,8,10-12H,5-7,9H2,(H,18,19) |
|---|---|
| SMILES | O=CNc1cc2CCc3ccc(CCc1cc2)cc3 |
| InChI Key | LCXUHIRWDWPRKN-UHFFFAOYSA-N |
| Molecular Formula | C17H17NO |
| Exact Mass | 251.323 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/LCXUHIRWDWPRKN-UHFFFAOYSA-N/CHMO0000726 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/LCXUHIRWDWPRKN-UHFFFAOYSA-N/CHMO0000726 |
| Version | |
| Author | Mareen Stahlberger |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2022-07-25 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | high resolution fast-atom bombardment mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 164889662 | PubChem |
| The data in this table is sourced from UniChem at EBI. | |