| SpectraBase Compound ID | HY9YJflatFC |
|---|---|
| InChI | InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h13-18H,3-12H2,1-2H3/b14-13-,16-15+,18-17+/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D,14D,15D,16D,17D,18D |
| InChIKey | FCNUJOJMMBVSPQ-ZRDQHIPUSA-N |
| Mol Weight | 324.66 g/mol |
| Molecular Formula | C192D32O2 |
| Exact Mass | 324.441086 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6T5ZXrMojEX |
|---|---|
| Name | Octadecatrienoic-D29 acid, methyl-D3 ester |
| CAS Registry Number | 11067-91-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19D32O2 |
| InChI | InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h13-18H,3-12H2,1-2H3/b14-13-,16-15+,18-17+/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D,14D,15D,16D,17D,18D |
| InChIKey | FCNUJOJMMBVSPQ-ZRDQHIPUSA-N |
| Molecular Weight | 324.658 g/mol |
| SMILES | C(\C(=C\(\C(=C\(\C(=C/(C(C(C(C(C(C(C(C(C(C(C([2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])([2D])[2D])[2D])[2D])[2D])[2D])[2D])[2D])(=O)OC([2D])([2D])[2D] |
| SPLASH | splash10-007a-9400000000-e352429e1f05fcc2b22e |
| Source of Spectrum | D-9-4864-12 |
| Synonyms | Methyl octadecatrienoate -D32 |
| Wiley ID | 1295931 |