| SpectraBase Compound ID | LDBY0zPGxtU |
|---|---|
| InChI | InChI=1S/C13H24/c1-3-13-11-9-7-5-4-6-8-10-12(13)2/h3-11H2,1-2H3/b13-12- |
| InChIKey | MAYUIWNLUGNWOD-SEYXRHQNSA-N |
| Mol Weight | 180.33 g/mol |
| Molecular Formula | C13H24 |
| Exact Mass | 180.187801 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jv87Mxl9mAK |
|---|---|
| Name | Cyclodecene, 1-ethyl-2-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.187800773 u |
| Formula | C13H24 |
| InChI | InChI=1S/C13H24/c1-3-13-11-9-7-5-4-6-8-10-12(13)2/h3-11H2,1-2H3/b13-12- |
| InChIKey | MAYUIWNLUGNWOD-SEYXRHQNSA-N |
| Molecular Weight | 180.335 g/mol |
| SMILES | C1CCCCC\C(=C/(CC1)C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916825 |