| SpectraBase Compound ID | 4Xk0AtWF7ms |
|---|---|
| InChI | InChI=1S/C10H16O/c1-5-9(2)6-7-10(3,4)8-11/h5-6,8H,1,7H2,2-4H3/b9-6+ |
| InChIKey | AAIFLYHFUMAOGG-RMKNXTFCSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C10H16O |
| Exact Mass | 152.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EDvM1XMsVUC |
|---|---|
| Name | (4E)-2,2,5-Trimethylhepta-4,6-dienal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.120115134 u |
| Formula | C10H16O |
| InChI | InChI=1S/C10H16O/c1-5-9(2)6-7-10(3,4)8-11/h5-6,8H,1,7H2,2-4H3/b9-6+ |
| InChIKey | AAIFLYHFUMAOGG-RMKNXTFCSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C(C=O)(C\C=C\(C=C)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.924817 |