| SpectraBase Compound ID | KDjWpVrByWP |
|---|---|
| InChI | InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3-8H,1-2H3/b5-3+,6-4+,8-7+ |
| InChIKey | CGMDPTNRMYIZTM-NKYSMPERSA-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 | BivN4vExcMV |
|---|---|
| Name | 2,4,6-OCTATRIEN, ALL-trans |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12 |
| InChI | InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3-8H,1-2H3/b5-3+,6-4+,8-7+ |
| InChIKey | CGMDPTNRMYIZTM-NKYSMPERSA-N |
| Instrument Name | CH7 |
| Molecular Weight | 108.0936 |
| SMILES | C\C=C\C=C\C=C\C |
| SPLASH | splash10-002f-9100000000-fe3ec0797629f4c774d7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |