| SpectraBase Compound ID | 8F1YUkM0PWc |
|---|---|
| InChI | InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3,6H,1-2,5,7-8H2 |
| InChIKey | XWATUFMZTKDTRB-UHFFFAOYSA-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 | 2E1QTeJD6G |
|---|---|
| Name | Octa-1,2,7-triene |
| 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/h3,6H,1-2,5,7-8H2 |
| InChIKey | XWATUFMZTKDTRB-UHFFFAOYSA-N |
| Molecular Weight | 108.184 g/mol |
| SMILES | C(=C=C)CCCC=C |
| SPLASH | splash10-0fvl-9000000000-50d59083635f30587ef7 |
| Source of Spectrum | J-58-6522-3 |
| Wiley ID | 1122042 |