| SpectraBase Compound ID | 5tJ5Yxh5WLA |
|---|---|
| InChI | InChI=1S/C23H42O4/c1-2-3-4-11-16-21(27-23-19-14-15-20-26-23)17-12-9-7-5-6-8-10-13-18-22(24)25/h9,12,21,23H,2-8,10-11,13-20H2,1H3,(H,24,25)/b12-9-/t21-,23?/m0/s1 |
| InChIKey | LUYIJSNFKUROSL-LSJWHPMVSA-N |
| Mol Weight | 382.6 g/mol |
| Molecular Formula | C23H42O4 |
| Exact Mass | 382.30831 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 23BzCvCHm1G |
|---|---|
| Name | 12-O-THP-9-cis-octadecenoic acid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H42O4 |
| InChI | InChI=1S/C23H42O4/c1-2-3-4-11-16-21(27-23-19-14-15-20-26-23)17-12-9-7-5-6-8-10-13-18-22(24)25/h9,12,21,23H,2-8,10-11,13-20H2,1H3,(H,24,25)/b12-9-/t21-,23?/m0/s1 |
| InChIKey | LUYIJSNFKUROSL-LSJWHPMVSA-N |
| Molecular Weight | 382.585 g/mol |
| SMILES | OC(=O)CCCCCCC\C=C/C[C@@](OC1OCCCC1)(CCCCCC)[H] |
| SPLASH | splash10-000i-9000000000-1c891d4120b02f6c52cd |
| Source of Spectrum | SK-20-1310-2 |
| Wiley ID | 851458 |