| SpectraBase Compound ID | KtX8BynC3Wh |
|---|---|
| InChI | InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3-7H,1,8H2,2H3/b6-4+,7-5+ |
| InChIKey | PKHBEGZTQNOZLP-YDFGWWAZSA-N |
| Mol Weight | 108.18 g/mol |
| Molecular Formula | C8H12 |
| Exact Mass | 108.0939 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LuJkq63RKO9 |
|---|---|
| Name | 1,3,6-Octatriene |
| Alternate Name(s) | (3E,6E)-1,3,6-Octatriene (3E,6E)-octa-1,3,6-triene (E,E)-1,3,6-Octatriene 1,3,6-Octatriene, (E,E)- trans,trans-1,3,6-Octatriene |
| CAS Registry Number | 22038-69-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12 |
| InChI | InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3-7H,1,8H2,2H3/b6-4+,7-5+ |
| InChIKey | PKHBEGZTQNOZLP-YDFGWWAZSA-N |
| Molecular Weight | 108.184 g/mol |
| SMILES | C(\C=C\C=C)\C=C\C |
| SPLASH | splash10-004l-9000000000-e9aa2d74218e4f0a3e26 |
| Source of Spectrum | HE-1982-0-0 |
| Wiley ID | 1121899 |