| SpectraBase Compound ID | 1WRA00HFlai |
|---|---|
| InChI | InChI=1S/C22H32O3/c1-2-3-4-5-6-9-12-15-18-21(23)19-16-13-10-7-8-11-14-17-20-22(24)25/h4-5,7-9,12-18,21,23H,2-3,6,10-11,19-20H2,1H3,(H,24,25)/b5-4-,8-7-,12-9-,16-13-,17-14-,18-15+ |
| InChIKey | DBZPUMBQEHGGEU-JCGBDYQPSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C22H32O3 |
| Exact Mass | 344.235145 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2wVBHcGZr0b |
|---|---|
| Name | 12-hydroxydocosa-3,6,9,13,15,18-hexaenoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32O3 |
| InChI | InChI=1S/C22H32O3/c1-2-3-4-5-6-9-12-15-18-21(23)19-16-13-10-7-8-11-14-17-20-22(24)25/h4-5,7-9,12-18,21,23H,2-3,6,10-11,19-20H2,1H3,(H,24,25)/b5-4-,8-7-,12-9-,16-13-,17-14-,18-15+ |
| InChIKey | DBZPUMBQEHGGEU-JCGBDYQPSA-N |
| Instrument Name | GCMS |
| Ionization Type | EI |
| Molecular Weight | 344.495 g/mol |
| SMILES | OC(C\C=C/C\C=C/C\C=C/CC(\C=C\C=C/C\C=C/CCC)O)=O |
| SPLASH | splash10-004i-0289000000-3cb83dd3beae8f5e697a |
| Source of Spectrum | AU2005222706B2 |
| Wiley ID | 1870279 |