| SpectraBase Compound ID | KsRuoRdU1m3 |
|---|---|
| InChI | InChI=1S/C12H20O/c1-11-6-3-4-7-12(11,2)9-10(13)5-8-11/h3-9H2,1-2H3/t11-,12-/m1/s1 |
| InChIKey | CUUZZZQYSLHVPL-VXGBXAGGSA-N |
| Mol Weight | 180.29 g/mol |
| Molecular Formula | C12H20O |
| Exact Mass | 180.151415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HzQovVXUTSt |
|---|---|
| Name | Trans-5,10-dimethyldecalone-2 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.151415263 u |
| Formula | C12H20O |
| InChI | InChI=1S/C12H20O/c1-11-6-3-4-7-12(11,2)9-10(13)5-8-11/h3-9H2,1-2H3/t11-,12-/m1/s1 |
| InChIKey | CUUZZZQYSLHVPL-VXGBXAGGSA-N |
| Molecular Weight | 180.291 g/mol |
| SMILES | [C@]12([C@](CCC(C2)=O)(C)CCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972335 |