| SpectraBase Compound ID | BEXfRF73qBN |
|---|---|
| InChI | InChI=1S/C10H16/c1-6-9(4)7-10(5)8(2)3/h6H,2,5,7H2,1,3-4H3/b9-6+ |
| InChIKey | NUVZHUHADLUEJS-RMKNXTFCSA-N |
| Mol Weight | 136.24 g/mol |
| Molecular Formula | C10H16 |
| Exact Mass | 136.125201 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EFJj7agkdmK |
|---|---|
| Name | 1,5-Heptadiene, 2,5-dimethyl-3-methylene- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.125200515 u |
| Formula | C10H16 |
| InChI | InChI=1S/C10H16/c1-6-9(4)7-10(5)8(2)3/h6H,2,5,7H2,1,3-4H3/b9-6+ |
| InChIKey | NUVZHUHADLUEJS-RMKNXTFCSA-N |
| Molecular Weight | 136.238 g/mol |
| SMILES | C(C(C(C)=C)=C)\C(=C\C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.982019 |