| SpectraBase Compound ID | 6HaK6r0kk0M |
|---|---|
| InChI | InChI=1S/C15H24/c1-12(2)5-6-13(3)10-8-15(11(10)7-12)9-14(13,15)4/h10-11H,5-9H2,1-4H3 |
| InChIKey | SHHUNSXMTDBLEV-UHFFFAOYSA-N |
| Mol Weight | 204.36 g/mol |
| Molecular Formula | C15H24 |
| Exact Mass | 204.187801 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KWaE3oUPUJx |
|---|---|
| Name | Longicyclene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.187800773 u |
| Formula | C15H24 |
| InChI | InChI=1S/C15H24/c1-12(2)5-6-13(3)10-8-15(11(10)7-12)9-14(13,15)4/h10-11H,5-9H2,1-4H3 |
| InChIKey | SHHUNSXMTDBLEV-UHFFFAOYSA-N |
| Molecular Weight | 204.357 g/mol |
| SMILES | C123C(C4(C(C3CC(CC4)(C)C)C2)C)(C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.883177 |