| SpectraBase Compound ID | FwcqPUvPKQZ |
|---|---|
| InChI | InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H,6-7H2,1H3,(H,9,10)/b3-2+,5-4+ |
| InChIKey | GVKGXDFZFAFBIW-MQQKCMAXSA-N |
| Mol Weight | 140.18 g/mol |
| Molecular Formula | C8H12O2 |
| Exact Mass | 140.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 41rbujhWlqS |
|---|---|
| Name | 4,6-Octadienoic acid, (E,E)- |
| CAS Registry Number | 75283-36-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O2 |
| InChI | InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-5H,6-7H2,1H3,(H,9,10)/b3-2+,5-4+ |
| InChIKey | GVKGXDFZFAFBIW-MQQKCMAXSA-N |
| Molecular Weight | 140.182 g/mol |
| SMILES | OC(=O)CC\C=C\C=C\C |
| SPLASH | splash10-005c-9100000000-ee91a72e2bebe444d24a |
| Source of Spectrum | J-45-5024-0 |
| Synonyms | 4,5-Octadienoic acid |
| Wiley ID | 1139233 |