Dataset
5-UNDECANONE; EI-B; MS
Chemical Information
| InChI | InChI=1S/C11H22O/c1-3-5-7-8-10-11(12)9-6-4-2/h3-10H2,1-2H3 |
|---|---|
| SMILES | CCCCCCC(=O)CCCC |
| InChI Key | WENNKWXPAWNIOO-UHFFFAOYSA-N |
| Molecular Formula | C11H22O |
| Exact Mass | 170.167 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP007049 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 531685 | surechembl |
| 98677 | pubchem |
| 0HA3U4E7AN | fdasrs |
| Molport-001-787-639 | molport |
| The data in this table is sourced from UniChem at EBI. | |