| SpectraBase Compound ID | 6IUCR9enUYa |
|---|---|
| InChI | InChI=1S/C14H24O/c1-11(15)9-8-10-12(13(2,3)4)14(5,6)7/h8-10H,1-7H3/b9-8+ |
| InChIKey | ZRXBGPROSVJVAC-CMDGGOBGSA-N |
| Mol Weight | 208.34 g/mol |
| Molecular Formula | C14H24O |
| Exact Mass | 208.182715 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BspzXMVEzYY |
|---|---|
| Name | E-6,6-di-Tert-butylhexa-3,5-dien-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.182715392 u |
| Formula | C14H24O |
| InChI | InChI=1S/C14H24O/c1-11(15)9-8-10-12(13(2,3)4)14(5,6)7/h8-10H,1-7H3/b9-8+ |
| InChIKey | ZRXBGPROSVJVAC-CMDGGOBGSA-N |
| Molecular Weight | 208.345 g/mol |
| SMILES | C(C(=C\C=C\C(=O)C)C(C)(C)C)(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819091 |